A0A087X2B0_HUMAN Loading...

Zinc finger protein 79

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087X2B0, Species HUMAN (Homo sapiens, Human), Gene ZNF79, Length 364 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	31.7	Very low	241 Å²	241	136.5 Å²	136.5	100%	1.187	84%	0.84	S	S	*	*				0	100.7	0	-71.4	169.3	92.8	0	0	108
2	P	48.2	Very low	31.1	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	83%	0.833	S	S	*	*			trans	-78.6	179.2	150.9	40.3	-32	0	0	0	107.9
3	P	47.1	Very low	30.9	Very low	131 Å²	131	138.2 Å²	138.2	85%	0.851	83%	0.831	S	S	*	*			cis	-140.7	-173.7	42.6	35.6	-10.4	0	0	0	113.1
4	G	29.3	Very low	30.5	Very low	67 Å²	67	140.6 Å²	140.6	69%	0.691	83%	0.829	S	S	*	*			cis	-176.2	170.5	13.1	0	0	0	0	0	112.7
5	D	27.3	Very low	30.4	Very low	161 Å²	161	143.1 Å²	143.1	86%	0.861	83%	0.825	S	S	*	*			trans	-68.5	159.1	-174.1	-54	-73.3	0	0	0	115.6
6	S	30.3	Very low	30.1	Very low	132 Å²	132	140.4 Å²	140.4	92%	0.923	82%	0.817	S	S	*	*			trans	-159.7	139.3	138	-70.6	0	0	0	0	111
7	D	26.2	Very low	29.9	Very low	147 Å²	147	144 Å²	144	79%	0.786	82%	0.821	S	S	*	*			trans	-96.5	-172	-159	-152.7	-15.4	0	0	0	113
8	H	30.6	Very low	29.8	Very low	184 Å²	184	144.3 Å²	144.3	85%	0.852	82%	0.82	S	S	*	*			trans	94.8	124.6	175.7	-52.7	76.8	0	0	0	113.8
9	G	24.8	Very low	29.6	Very low	62 Å²	62	145.7 Å²	145.7	64%	0.639	82%	0.824	S	S	*	*			cis	145.8	116.7	10.1	0	0	0	0	0	108.8
10	T	24.5	Very low	29.6	Very low	140 Å²	140	149.8 Å²	149.8	86%	0.859	83%	0.826	S	S	*	*			trans	52.9	121.7	150.7	65.9	0	0	0	0	120.8
11	S	27.2	Very low	29.6	Very low	115 Å²	115	148.1 Å²	148.1	80%	0.804	82%	0.822	S	S	*	*				-178.8	122.2	104.9	65.1	0	0	0	0	111.9
12	D	25.1	Very low	29.5	Very low	142 Å²	142	143.2 Å²	143.2	76%	0.759	81%	0.805	S	S	*	*			trans	-51.8	147.3	166.3	-60.4	-73.6	0	0	0	114
13	L	28.3	Very low	28.6	Very low	154 Å²	154	145 Å²	145	81%	0.806	81%	0.808	S	S	*	*			trans	-147.7	93.6	133.9	-133.8	106.4	0	0	0	109.9	K15	L13-K15 PolarHBondContact O-N 2.79Å
14	E	24.6	Very low	27.8	Very low	172 Å²	172	143.7 Å²	143.7	80%	0.804	80%	0.801	S	S	*	*			trans	-52.6	127.2	158.2	-70.1	-177.3	116.1	0	0	110.2
15	K	29.2	Very low	28.1	Very low	177 Å²	177	146.8 Å²	146.8	77%	0.77	81%	0.809	S	S	*	*			trans	-127.6	92.2	148.9	-83.8	-174.1	-179.1	173.5	0	109.2	L13 F17	L13-K15 PolarHBondContact O-N 2.79Å; K15-F17 PolarHBondContact O-N 3.09Å
16	S	25.4	Very low	28.3	Very low	100 Å²	100	147.4 Å²	147.4	70%	0.699	81%	0.807	S	S	*	*			trans	-43.9	113.7	159.1	30.1	0	0	0	0	112.2
17	F	27.1	Very low	28.4	Very low	202 Å²	202	150.1 Å²	150.1	89%	0.886	81%	0.805	S	S	*	*			trans	-97.1	104.3	157.2	-95.2	-87	0	0	0	108.6	K15 L19	K15-F17 PolarHBondContact O-N 3.09Å; F17-L19 PolarHBondContact O-N 3.34Å
18	N	27.8	Very low	28.6	Very low	150 Å²	150	154.8 Å²	154.8	80%	0.802	81%	0.812	S	S	*	*			trans	-49.8	115.5	171.5	-80.7	-64.4	0	0	0	111.2	R20	N18-R20 PolarHBondContact O-N 3.32Å; N18-R20 VanDerWaalsContact O-N 3.15Å
19	L	26.8	Very low	28.5	Very low	171 Å²	171	152 Å²	152	90%	0.895	81%	0.807	S	S	*	*			trans	-63.9	107.1	162.1	-74.3	162.8	0	0	0	108.2	F17	F17-L19 PolarHBondContact O-N 3.34Å
20	R	29.3	Very low	28.8	Very low	226 Å²	226	154.9 Å²	154.9	85%	0.853	82%	0.815	S	S	*	*			trans	-66.9	130.9	162.7	-81.8	-174.5	176.9	-172.4	-0.4	108.3	N18 V22	N18-R20 PolarHBondContact O-N 3.32Å; N18-R20 VanDerWaalsContact O-N 3.15Å; R20-V22 PolarHBondContact O-N 3.33Å
21	P	29.8	Very low	29.2	Very low	116 Å²	116	154.5 Å²	154.5	75%	0.753	81%	0.812	S	S	*	*			trans	-63.1	124.1	173.7	-16.2	28.7	0	0	0	109.7	L23	P21-L23 PolarHBondContact O-N 3.17Å
22	V	31	Very low	29.4	Very low	138 Å²	138	158 Å²	158	84%	0.836	82%	0.816	S	S	*	*			trans	-71.6	100	169.8	178.3	0	0	0	0	107.3	R20 S24	R20-V22 PolarHBondContact O-N 3.33Å; V22-S24 PolarHBondContact O-N 3.05Å
23	L	29.4	Very low	30.2	Very low	159 Å²	159	155 Å²	155	83%	0.832	81%	0.81	S	S	*	*			trans	-59.1	124.6	169.1	-77	162.7	0	0	0	109.5	P21	P21-L23 PolarHBondContact O-N 3.17Å
24	S	30.7	Very low	31	Very low	102 Å²	102	158.3 Å²	158.3	71%	0.713	81%	0.812	S	S	*	*			trans	-66.8	130.2	174.4	-44.6	0	0	0	0	110.6	V22 Q26	V22-S24 PolarHBondContact O-N 3.05Å; S24-Q26 PolarHBondContact O-N 3.47Å
25	P	35.8	Very low	32.3	Very low	133 Å²	133	154.4 Å²	154.4	86%	0.864	80%	0.802	S	S	*	*			trans	-73.8	101.9	169.2	-16.1	31.2	0	0	0	109.7
26	Q	30.9	Very low	34	Very low	174 Å²	174	153.5 Å²	153.5	81%	0.813	79%	0.794	S	S	*	*			trans	-59.3	134.3	167.3	-69.1	-178.9	-10.6	0	0	110.7	S24	S24-Q26 PolarHBondContact O-N 3.47Å
27	Q	31.2	Very low	35.6	Very low	188 Å²	188	158.3 Å²	158.3	88%	0.879	80%	0.802	S	S	*	*			trans	23.5	99.5	147.6	-63.8	176.1	-24.7	0	0	116.8
28	R	32.1	Very low	36.9	Very low	246 Å²	246	150.9 Å²	150.9	93%	0.928	78%	0.775	S	S	*	*			trans	-85.8	121.3	157.3	-99.1	-175.8	-116.9	-135	-2.6	109.7
29	V	27.9	Very low	37.8	Very low	124 Å²	124	152.4 Å²	152.4	75%	0.752	78%	0.777	S	S	*	*			trans	-53.6	146	166.9	-151.2	0	0	0	0	110.1	V31	V29-V31 PolarHBondContact O-N 3.3Å; V29-V31 VanDerWaalsContact O-N 3.09Å
30	P	30.6	Very low	38.4	Very low	123 Å²	123	147.4 Å²	147.4	80%	0.799	75%	0.753	S	S	*	*			trans	-66.6	112.5	179.4	-14.9	29	0	0	0	110.2	E32	P30-E32 PolarHBondContact O-N 2.85Å
31	V	32.8	Very low	38.8	Very low	133 Å²	133	146 Å²	146	81%	0.806	76%	0.756	S	S	*	*			trans	-79.3	115.5	163.4	-177.3	0	0	0	0	106.1	V29 A33	V29-V31 PolarHBondContact O-N 3.3Å; V29-V31 VanDerWaalsContact O-N 3.09Å; V31-A33 PolarHBondContact O-N 3.48Å
32	E	31	Very low	38.8	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.883	75%	0.753	S	S	*	*			trans	-54.4	107.3	172.4	-74.8	-169.9	146.6	0	0	109.7	P30 R34	P30-E32 PolarHBondContact O-N 2.85Å; E32-R34 PolarHBondContact O-N 3.15Å; E32-R34 VanDerWaalsContact O-N 3.16Å
33	A	42.4	Very low	39	Very low	78 Å²	78	147.7 Å²	147.7	65%	0.645	75%	0.753	S	S	*	*			trans	-71.3	110.9	179.6	0	0	0	0	0	109.2	V31	V31-A33 PolarHBondContact O-N 3.48Å
34	R	44.9	Very low	39	Very low	223 Å²	223	145.6 Å²	145.6	84%	0.842	75%	0.751	S	S	*	*			trans	-52.7	139.7	170	-83.8	-174.2	178.9	-170.2	0.3	110.2	E32 R36	E32-R34 PolarHBondContact O-N 3.15Å; E32-R34 VanDerWaalsContact O-N 3.16Å; R34-R36 PolarHBondContact O-N 3.48Å
35	P	52.8	Low	39.1	Very low	90 Å²	90	148.9 Å²	148.9	58%	0.584	75%	0.753	S	S	*	*			trans	-53.2	124.1	176.7	-22.2	30.4	0	0	0	110.8	K37	P35-K37 PolarHBondContact O-N 3.07Å
36	R	64.3	Low	38.9	Very low	159 Å²	159	152.1 Å²	152.1	60%	0.6	75%	0.753	S	S	*	*			trans	-82.9	114.7	175.7	-68.9	-170.7	-178.1	-143.5	2.6	108.6	R34 P142 Y143	R34-R36 PolarHBondContact O-N 3.48Å; R36-P142 PolarHBondContact N-O 2.75Å; R36-Y143 HydrophobicContact CB-CD1 4.14Å; R36-Y143 HydrophobicContact CB-CE1 3.93Å
37	K	58.3	Low	38.8	Very low	200 Å²	200	151.6 Å²	151.6	87%	0.87	76%	0.756	S	S	*	*			trans	-71	141	167.8	-65.9	-175.6	179.3	-176.8	0	108.8	P35	P35-K37 PolarHBondContact O-N 3.07Å
38	C	56.3	Low	38.8	Very low	47 Å²	47	147.8 Å²	147.8	32%	0.318	75%	0.75	S	S	.	*			trans	-99	120.8	167.3	-154.9	0	0	0	0	108.9	T40 C155	C38-T40 PolarHBondContact O-N 3.21Å; C38-C155 HydrophobicContact CB-CB 3.82Å; C38-C155 WeakPolarHBondContact CB-SG 3.19Å; C38-C155 WeakPolarHBondContact SG-CB 3.16Å; C38-C155 CovalentContact SG-SG 1.99Å; C38-C155 PolarHBondContact SG-SG 3.32Å
39	E	45.1	Very low	39	Very low	181 Å²	181	144.7 Å²	144.7	85%	0.846	75%	0.746	S	S	*	*			trans	-82.6	104.7	174.5	-69.1	172	-178.2	0	0	107.8
40	T	40.1	Very low	39.4	Very low	66 Å²	66	145.6 Å²	145.6	41%	0.405	75%	0.745	S	S	.	*			trans	-88.8	124.3	166.9	49.8	0	0	0	0	108.1	C38 T42 V159	C38-T40 PolarHBondContact O-N 3.21Å; T40-T42 PolarHBondContact O-N 3.48Å; T40-V159 HydrophobicContact CG2-CB 4.36Å; T40-V159 HydrophobicContact CG2-CG1 3.93Å; T40-V159 HydrophobicContact CG2-CG2 3.45Å; T40-V159 VanDerWaalsContact CG2-CG2 3.45Å
41	H	37.4	Very low	39.8	Very low	198 Å²	198	147.5 Å²	147.5	92%	0.917	75%	0.748	S	S	*	*			trans	-68.4	82.8	167.3	-83.4	-88.7	0	0	0	109.3
42	T	31.1	Very low	39.8	Very low	111 Å²	111	149.2 Å²	149.2	68%	0.681	75%	0.745	S	S	*	*			trans	-138	105.2	161.6	48.2	0	0	0	0	104.4	T40 S44	T40-T42 PolarHBondContact O-N 3.48Å; T42-S44 PolarHBondContact O-N 2.99Å
43	E	34.1	Very low	40.3	Very low	178 Å²	178	146.5 Å²	146.5	83%	0.832	74%	0.743	S	S	*	*			trans	-56	123.4	-174.2	-68.3	-173.1	139.2	0	0	111.9
44	S	29.2	Very low	40.5	Very low	114 Å²	114	151.9 Å²	151.9	80%	0.797	76%	0.755	S	S	*	*			trans	-159.8	97.6	148.8	-166.8	0	0	0	0	107.3	T42 K46	T42-S44 PolarHBondContact O-N 2.99Å; S44-K46 PolarHBondContact O-N 3.12Å
45	F	32.7	Very low	41.3	Very low	172 Å²	172	149.7 Å²	149.7	75%	0.754	75%	0.746	S	S	*	*			trans	-72.5	121.9	-179.5	-76.8	-92	0	0	0	110.5
46	K	31	Very low	42.1	Very low	201 Å²	201	148.9 Å²	148.9	87%	0.874	75%	0.748	S	S	*	*			trans	-130.5	125.3	147.4	-76.1	-169.9	178.4	179.9	0	109.1	S44	S44-K46 PolarHBondContact O-N 3.12Å
47	N	30.4	Very low	42.9	Very low	162 Å²	162	147.6 Å²	147.6	87%	0.866	75%	0.747	S	S	*	*			trans	-54.7	137.2	-171	-74.4	-29.2	0	0	0	114.6
48	S	30.4	Very low	43.9	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	73%	0.733	S	S	*	*			trans	-153.7	111.6	143.1	65.6	0	0	0	0	109	I50	S48-I50 PolarHBondContact O-N 3.27Å
49	E	35.3	Very low	45	Very low	182 Å²	182	145 Å²	145	85%	0.85	74%	0.737	S	S	*	*			trans	-61	122.6	174.4	-75.8	179.1	120.4	0	0	111.3
50	I	36.4	Very low	46.8	Very low	142 Å²	142	138.8 Å²	138.8	73%	0.728	72%	0.717	S	S	*	*			trans	-136.8	104.3	152	-59.4	-179.1	0	0	0	106.1	S48 K52	S48-I50 PolarHBondContact O-N 3.27Å; I50-K52 PolarHBondContact O-N 2.88Å
51	L	39.1	Very low	49	Very low	163 Å²	163	135.8 Å²	135.8	85%	0.853	70%	0.698	S	S	*	*			trans	-56	118.9	173.2	-88.1	97.3	0	0	0	110.3
52	K	33.7	Very low	51.1	Low	170 Å²	170	134 Å²	134	74%	0.739	70%	0.696	S	S	*	*			trans	-121.1	147.1	157.7	-73.4	-174.9	-178.1	176.3	0	107.8	I50 H54	I50-K52 PolarHBondContact O-N 2.88Å; K52-H54 PolarHBondContact O-N 3.06Å; K52-H54 VanDerWaalsContact O-N 3.1Å
53	P	41	Very low	53.5	Low	132 Å²	132	135.1 Å²	135.1	86%	0.857	69%	0.693	S	S	*	*			trans	-63.6	117.6	-170.3	22.5	-28.4	0	0	0	110.3	R55	P53-R55 PolarHBondContact O-N 3.26Å
54	H	47.2	Very low	55.9	Low	191 Å²	191	129.1 Å²	129.1	88%	0.884	67%	0.67	S	S	*	*			trans	-62.5	105.4	175.4	-94.2	-91.2	0	0	0	109.3	K52 A56	K52-H54 PolarHBondContact O-N 3.06Å; K52-H54 VanDerWaalsContact O-N 3.1Å; H54-A56 PolarHBondContact O-N 3.31Å; H54-A56 VanDerWaalsContact O-N 3.12Å
55	R	61.5	Low	58.3	Low	176 Å²	176	126.6 Å²	126.6	66%	0.664	66%	0.662	S	S	*	*			trans	-64.8	110.9	163.1	-154	179.5	-169	168.4	3.3	106.2	P53 K57 Y70	P53-R55 PolarHBondContact O-N 3.26Å; R55-K57 PolarHBondContact O-N 3.12Å; R55-Y70 PolarHBondContact NH2-OH 3.09Å
56	A	70.3	Confident	60.8	Low	74 Å²	74	124.3 Å²	124.3	61%	0.612	65%	0.652	S	S	*	*			trans	-50.7	136.1	-179	0	0	0	0	0	110.1	H54 P58 S69	H54-A56 PolarHBondContact O-N 3.31Å; H54-A56 VanDerWaalsContact O-N 3.12Å; A56-P58 VanDerWaalsContact O-CD 3.22Å; A56-P58 WeakPolarHBondContact O-CD 3.43Å; A56-S69 PolarHBondContact O-OG 2.87Å
57	K	80	Confident	63.5	Low	132 Å²	132	116.7 Å²	116.7	57%	0.574	63%	0.627	S	S	*	*			trans	-115.9	68.8	175.6	-68.5	179.3	176	-172.4	0	109.4	R55 Y59 A67 F68	R55-K57 PolarHBondContact O-N 3.12Å; K57-Y59 PolarHBondContact O-N 3.36Å; K57-A67 HydrophobicContact CB-CB 3.78Å; K57-A67 HydrophobicContact CD-CB 4.28Å; K57-F68 CarbonylContact C-O 3.21Å; K57-F68 VanDerWaalsContact C-O 3.25Å; K57-F68 VanDerWaalsContact CA-O 3.26Å; K57-F68 WeakPolarHBondContact CA-O 3.48Å
58	P	79.1	Confident	66.1	Low	91 Å²	91	111 Å²	111	59%	0.591	59%	0.594	S	S	*	*			trans	-72.2	-11.8	-170.6	28.1	-33.4	0	0	0	113.7	A56	A56-P58 VanDerWaalsContact O-CD 3.22Å; A56-P58 WeakPolarHBondContact O-CD 3.43Å
59	Y	80.8	Confident	68.8	Low	100 Å²	100	107.2 Å²	107.2	39%	0.392	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	103.7	-176	-55.8	-75.9	0	0	0	110.7	K57 A67 F68 C71	K57-Y59 PolarHBondContact O-N 3.36Å; Y59-A67 CarbonylContact O-C 3.6Å; Y59-A67 WeakPolarHBondContact O-CA 3.28Å; Y59-F68 PolarHBondContact N-O 3.17Å; Y59-F68 PolarHBondContact O-N 3.32Å; Y59-C71 HydrophobicContact CD1-CB 3.92Å; Y59-C71 HydrophobicContact CD2-CB 4.45Å; Y59-C71 VanDerWaalsContact CD2-N 3.29Å; Y59-C71 HydrophobicContact CE1-CB 3.75Å; Y59-C71 HydrophobicContact CE2-CB 4.28Å; Y59-C71 HydrophobicContact CG-CB 4.27Å
60	A	82.9	Confident	71.2	Confident	52 Å²	52	104.2 Å²	104.2	43%	0.43	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.6	179.9	0	0	0	0	0	112.4	K66 L74	A60-K66 CarbonylContact C-O 3.52Å; A60-K66 WeakPolarHBondContact CA-O 3.45Å; A60-L74 WeakPolarHBondContact O-CD2 3.22Å
61	C	85.9	Confident	73.4	Confident	2 Å²	2	100.3 Å²	100.3	1%	0.014	54%	0.535	C	S	.	.			trans	-84.1	118.7	171.6	178.7	0	0	0	0	109.8	E63 C64 G65 K66 F68 L74 H81	C61-E63 PolarHBondContact O-N 3.49Å; C61-C64 VanDerWaalsContact SG-SG 3.65Å; C61-G65 VanDerWaalsContact O-CA 3.25Å; C61-G65 WeakPolarHBondContact O-CA 3.03Å; C61-G65 PolarHBondContact O-N 3.12Å; C61-K66 WeakPolarHBondContact CB-O 3.44Å; C61-K66 PolarHBondContact N-O 3.4Å; C61-F68 HydrophobicContact CB-CE2 4.31Å; C61-L74 HydrophobicContact CB-CD1 3.58Å; C61-H81 PolarHBondContact SG-NE2 2.77Å; C61-H81 VanDerWaalsContact SG-NE2 3.45Å
62	N	81.3	Confident	75.5	Confident	161 Å²	161	96.8 Å²	96.8	86%	0.861	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.6	-178.8	-63.4	-20.2	0	0	0	113.4
63	E	80.5	Confident	77.9	Confident	135 Å²	135	90.6 Å²	90.6	63%	0.631	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-26.5	-176.6	-64.8	176.5	160.8	0	0	113.6	C61 H81	C61-E63 PolarHBondContact O-N 3.49Å; E63-H81 WeakPolarHBondContact OE2-CB 3.45Å; E63-H81 IonicContact OE2-CD2 3.92Å; E63-H81 PolarHBondContact OE2-CD2 2.89Å; E63-H81 IonicContact OE2-CG 3.12Å; E63-H81 IonicContact OE2-NE2 2.96Å
64	C	84.6	Confident	79.9	Confident	52 Å²	52	85.1 Å²	85.1	35%	0.351	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138	7.7	-177.3	74.4	0	0	0	0	114.8	C61 K66 H77 H81	C61-C64 VanDerWaalsContact SG-SG 3.65Å; C64-K66 PolarHBondContact O-N 3.28Å; C64-H77 PolarHBondContact SG-NE2 2.88Å; C64-H81 PolarHBondContact SG-NE2 2.84Å
65	G	80.6	Confident	81.5	Confident	61 Å²	61	78.6 Å²	78.6	63%	0.629	44%	0.441	S	S	*	.			trans	68.9	0.6	176.6	0	0	0	0	0	115.6	C61 A67	C61-G65 VanDerWaalsContact O-CA 3.25Å; C61-G65 WeakPolarHBondContact O-CA 3.03Å; C61-G65 PolarHBondContact O-N 3.12Å; G65-A67 PolarHBondContact O-N 3.15Å
66	K	85.1	Confident	82.5	Confident	123 Å²	123	74.5 Å²	74.5	54%	0.535	43%	0.429	S	S	.	.			trans	-69.5	129.8	-178.7	-71.5	179.4	-175.7	173.1	0	111.2	A60 C61 C64 F68	A60-K66 CarbonylContact C-O 3.52Å; A60-K66 WeakPolarHBondContact CA-O 3.45Å; C61-K66 WeakPolarHBondContact CB-O 3.44Å; C61-K66 PolarHBondContact N-O 3.4Å; C64-K66 PolarHBondContact O-N 3.28Å; K66-F68 HydrophobicContact CB-CE2 3.84Å; K66-F68 HydrophobicContact CB-CZ 3.93Å; K66-F68 WeakPolarHBondContact O-CD2 3.38Å; K66-F68 VanDerWaalsContact O-CE2 3.25Å; K66-F68 WeakPolarHBondContact O-CE2 3.25Å
67	A	86.7	Confident	83.1	Confident	42 Å²	42	72.2 Å²	72.2	35%	0.347	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	141.5	179.5	0	0	0	0	0	112.6	K57 Y59 G65	K57-A67 HydrophobicContact CB-CB 3.78Å; K57-A67 HydrophobicContact CD-CB 4.28Å; Y59-A67 CarbonylContact O-C 3.6Å; Y59-A67 WeakPolarHBondContact O-CA 3.28Å; G65-A67 PolarHBondContact O-N 3.15Å
68	F	86.6	Confident	83.2	Confident	41 Å²	41	69.9 Å²	69.9	18%	0.18	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.4	-174.8	-58	-89.6	0	0	0	110.8	K57 Y59 C61 K66 Y70 L74 H77	K57-F68 CarbonylContact C-O 3.21Å; K57-F68 VanDerWaalsContact C-O 3.25Å; K57-F68 VanDerWaalsContact CA-O 3.26Å; K57-F68 WeakPolarHBondContact CA-O 3.48Å; Y59-F68 PolarHBondContact N-O 3.17Å; Y59-F68 PolarHBondContact O-N 3.32Å; C61-F68 HydrophobicContact CB-CE2 4.31Å; K66-F68 HydrophobicContact CB-CE2 3.84Å; K66-F68 HydrophobicContact CB-CZ 3.93Å; K66-F68 WeakPolarHBondContact O-CD2 3.38Å; K66-F68 VanDerWaalsContact O-CE2 3.25Å; K66-F68 WeakPolarHBondContact O-CE2 3.25Å; F68-Y70 VanDerWaalsContact C-N 3.3Å; F68-L74 HydrophobicContact CB-CB 4.29Å; F68-L74 HydrophobicContact CD2-CB 3.82Å; F68-L74 HydrophobicContact CD2-CD1 3.7Å; F68-L74 HydrophobicContact CD2-CG 4.36Å; F68-L74 HydrophobicContact CE2-CD1 3.8Å; F68-L74 HydrophobicContact CG-CB 4.2Å; F68-H77 HydrophobicContact CE1-CB 3.86Å; F68-H77 HydrophobicContact CE2-CB 3.94Å; F68-H77 AromaticContact CE2-CD2 3.37Å; F68-H77 WeakPolarHBondContact CE2-CD2 3.35Å; F68-H77 AromaticContact CE2-CG 3.76Å; F68-H77 HydrophobicContact CZ-CB 3.38Å; F68-H77 AromaticContact CZ-CD2 3.32Å; F68-H77 WeakPolarHBondContact CZ-CD2 3.41Å; F68-H77 AromaticContact CZ-CG 3.24Å; F68-H77 AromaticContact CZ-ND1 3.98Å
69	S	86.9	Confident	83.4	Confident	30 Å²	30	68.7 Å²	68.7	21%	0.21	38%	0.383	C	S	.	.	S	Bend	trans	-77.4	-16.7	176.6	-61.5	0	0	0	0	113.3	A56	A56-S69 PolarHBondContact O-OG 2.87Å
70	Y	84.6	Confident	83.3	Confident	118 Å²	118	67.6 Å²	67.6	46%	0.463	39%	0.39	S	S	.	.	S	Bend	trans	-135.9	140.9	-177.5	-57.8	-74.4	0	0	0	110.7	R55 F68 S72 S73 L74	R55-Y70 PolarHBondContact NH2-OH 3.09Å; F68-Y70 VanDerWaalsContact C-N 3.3Å; Y70-S72 VanDerWaalsContact C-N 3.29Å; Y70-S72 PolarHBondContact O-N 3.09Å; Y70-S73 WeakPolarHBondContact O-CB 3.38Å; Y70-S73 PolarHBondContact O-N 3.08Å; Y70-S73 VanDerWaalsContact O-N 3.14Å; Y70-L74 PolarHBondContact O-N 3.38Å
71	C	83.7	Confident	83.1	Confident	61 Å²	61	68.8 Å²	68.8	41%	0.412	39%	0.386	S	S	.	.	H	α-helix	trans	-57.7	-41.9	175.8	-177.1	0	0	0	0	111.6	Y59 S73 L74 S75	Y59-C71 HydrophobicContact CD1-CB 3.92Å; Y59-C71 HydrophobicContact CD2-CB 4.45Å; Y59-C71 VanDerWaalsContact CD2-N 3.29Å; Y59-C71 HydrophobicContact CE1-CB 3.75Å; Y59-C71 HydrophobicContact CE2-CB 4.28Å; Y59-C71 HydrophobicContact CG-CB 4.27Å; C71-S73 VanDerWaalsContact C-N 3.26Å; C71-S73 PolarHBondContact O-N 3.38Å; C71-L74 CarbonylContact O-C 3.31Å; C71-L74 WeakPolarHBondContact O-CA 2.9Å; C71-L74 WeakPolarHBondContact O-CB 3.23Å; C71-L74 PolarHBondContact O-N 2.84Å; C71-S75 PolarHBondContact O-N 3.28Å; C71-S75 PolarHBondContact O-OG 3.12Å
72	S	82.4	Confident	82.8	Confident	88 Å²	88	72.7 Å²	72.7	62%	0.615	41%	0.41	S	S	*	.	H	α-helix	trans	-58.7	-35	176.9	56.4	0	0	0	0	113.5	Y70 Q76	Y70-S72 VanDerWaalsContact C-N 3.29Å; Y70-S72 PolarHBondContact O-N 3.09Å; S72-Q76 VanDerWaalsContact O-CB 3.29Å; S72-Q76 WeakPolarHBondContact O-CB 3.4Å; S72-Q76 PolarHBondContact O-N 3.3Å
73	S	83.9	Confident	82.7	Confident	40 Å²	40	67.3 Å²	67.3	28%	0.28	39%	0.392	S	S	.	.	H	α-helix	trans	-71.4	-37.4	175	-55.2	0	0	0	0	112	Y70 C71 H77	Y70-S73 WeakPolarHBondContact O-CB 3.38Å; Y70-S73 PolarHBondContact O-N 3.08Å; Y70-S73 VanDerWaalsContact O-N 3.14Å; C71-S73 VanDerWaalsContact C-N 3.26Å; C71-S73 PolarHBondContact O-N 3.38Å; S73-H77 VanDerWaalsContact O-CB 3.3Å; S73-H77 WeakPolarHBondContact O-CB 3.33Å; S73-H77 PolarHBondContact O-N 2.78Å
74	L	84.3	Confident	82.6	Confident	18 Å²	18	65.8 Å²	65.8	9%	0.094	39%	0.385	C	S	.	.	H	α-helix	trans	-65.1	-47.9	172.4	173.6	61.8	0	0	0	111	A60 C61 F68 Y70 C71 Q76 H77 Q78	A60-L74 WeakPolarHBondContact O-CD2 3.22Å; C61-L74 HydrophobicContact CB-CD1 3.58Å; F68-L74 HydrophobicContact CB-CB 4.29Å; F68-L74 HydrophobicContact CD2-CB 3.82Å; F68-L74 HydrophobicContact CD2-CD1 3.7Å; F68-L74 HydrophobicContact CD2-CG 4.36Å; F68-L74 HydrophobicContact CE2-CD1 3.8Å; F68-L74 HydrophobicContact CG-CB 4.2Å; Y70-L74 PolarHBondContact O-N 3.38Å; C71-L74 CarbonylContact O-C 3.31Å; C71-L74 WeakPolarHBondContact O-CA 2.9Å; C71-L74 WeakPolarHBondContact O-CB 3.23Å; C71-L74 PolarHBondContact O-N 2.84Å; L74-Q76 VanDerWaalsContact C-N 3.31Å; L74-Q76 PolarHBondContact O-N 3.23Å; L74-H77 CarbonylContact O-C 3.6Å; L74-H77 WeakPolarHBondContact O-CA 3.35Å; L74-H77 WeakPolarHBondContact O-CB 3.43Å; L74-H77 PolarHBondContact O-N 3.18Å; L74-Q78 HydrophobicContact CD1-CG 4.25Å; L74-Q78 WeakPolarHBondContact O-CG 3.3Å; L74-Q78 PolarHBondContact O-N 3.45Å
75	S	80.7	Confident	82.6	Confident	54 Å²	54	69.3 Å²	69.3	38%	0.378	40%	0.395	S	S	.	.	H	α-helix	trans	-60.8	-39.9	177.6	-54.5	0	0	0	0	112.3	C71 H77 Q78	C71-S75 PolarHBondContact O-N 3.28Å; C71-S75 PolarHBondContact O-OG 3.12Å; S75-H77 VanDerWaalsContact C-N 3.34Å; S75-Q78 PolarHBondContact O-N 3Å
76	Q	81.7	Confident	82.9	Confident	90 Å²	90	70.2 Å²	70.2	42%	0.421	39%	0.389	S	S	.	.	H	α-helix	trans	-65.6	-37.8	173.6	-178.4	177.5	65	0	0	112.1	S72 L74 K79 Q98	S72-Q76 VanDerWaalsContact O-CB 3.29Å; S72-Q76 WeakPolarHBondContact O-CB 3.4Å; S72-Q76 PolarHBondContact O-N 3.3Å; L74-Q76 VanDerWaalsContact C-N 3.31Å; L74-Q76 PolarHBondContact O-N 3.23Å; Q76-K79 WeakPolarHBondContact O-CB 3.48Å; Q76-Q98 HydrophobicContact CG-CG 4.41Å
77	H	83.5	Confident	83.1	Confident	25 Å²	25	68.7 Å²	68.7	12%	0.116	38%	0.381	C	S	.	.	H	α-helix	trans	-68.6	-38.3	176.5	168.5	58.4	0	0	0	112.5	C64 F68 S73 L74 S75 K79 S80 H81	C64-H77 PolarHBondContact SG-NE2 2.88Å; F68-H77 HydrophobicContact CE1-CB 3.86Å; F68-H77 HydrophobicContact CE2-CB 3.94Å; F68-H77 AromaticContact CE2-CD2 3.37Å; F68-H77 WeakPolarHBondContact CE2-CD2 3.35Å; F68-H77 AromaticContact CE2-CG 3.76Å; F68-H77 HydrophobicContact CZ-CB 3.38Å; F68-H77 AromaticContact CZ-CD2 3.32Å; F68-H77 WeakPolarHBondContact CZ-CD2 3.41Å; F68-H77 AromaticContact CZ-CG 3.24Å; F68-H77 AromaticContact CZ-ND1 3.98Å; S73-H77 VanDerWaalsContact O-CB 3.3Å; S73-H77 WeakPolarHBondContact O-CB 3.33Å; S73-H77 PolarHBondContact O-N 2.78Å; L74-H77 CarbonylContact O-C 3.6Å; L74-H77 WeakPolarHBondContact O-CA 3.35Å; L74-H77 WeakPolarHBondContact O-CB 3.43Å; L74-H77 PolarHBondContact O-N 3.18Å; S75-H77 VanDerWaalsContact C-N 3.34Å; H77-K79 PolarHBondContact O-N 3.27Å; H77-S80 PolarHBondContact ND1-OG 3.11Å; H77-S80 VanDerWaalsContact O-CB 3.27Å; H77-S80 WeakPolarHBondContact O-CB 3.45Å; H77-S80 PolarHBondContact O-N 3.4Å; H77-S80 PolarHBondContact O-OG 2.97Å; H77-H81 AromaticContact CE1-CE1 3.86Å; H77-H81 AromaticContact CE1-NE2 3.38Å; H77-H81 PolarHBondContact CE1-NE2 3.11Å; H77-H81 AromaticContact NE2-CD2 3.97Å; H77-H81 AromaticContact NE2-CE1 3.96Å; H77-H81 AromaticContact NE2-NE2 3.11Å; H77-H81 PolarHBondContact NE2-NE2 2.89Å; H77-H81 VanDerWaalsContact NE2-NE2 3.11Å
78	Q	81.5	Confident	83.2	Confident	83 Å²	83	72.8 Å²	72.8	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-58	-32.3	177.2	-75.8	172	-46.8	0	0	112.4	L74 S75 S80 H81 T82	L74-Q78 HydrophobicContact CD1-CG 4.25Å; L74-Q78 WeakPolarHBondContact O-CG 3.3Å; L74-Q78 PolarHBondContact O-N 3.45Å; S75-Q78 PolarHBondContact O-N 3Å; Q78-S80 PolarHBondContact O-N 2.87Å; Q78-H81 PolarHBondContact O-N 3.05Å; Q78-T82 PolarHBondContact O-N 3.07Å
79	K	82.6	Confident	83.4	Confident	67 Å²	67	70.9 Å²	70.9	29%	0.291	39%	0.385	S	S	.	.	H	α-helix	trans	-59.1	-20.6	172.8	-62.3	-177.2	179.1	-171.6	0	114.1	Q76 H77 T82 G83 E84	Q76-K79 WeakPolarHBondContact O-CB 3.48Å; H77-K79 PolarHBondContact O-N 3.27Å; K79-T82 WeakPolarHBondContact CA-OG1 3.41Å; K79-G83 PolarHBondContact O-N 3.01Å; K79-E84 PolarHBondContact O-N 3.46Å
80	S	79.2	Confident	83.5	Confident	77 Å²	77	74.7 Å²	74.7	54%	0.538	41%	0.412	S	S	.	.	H	α-helix	trans	-75.2	-23.8	174.8	72.6	0	0	0	0	113.6	H77 Q78	H77-S80 PolarHBondContact ND1-OG 3.11Å; H77-S80 VanDerWaalsContact O-CB 3.27Å; H77-S80 WeakPolarHBondContact O-CB 3.45Å; H77-S80 PolarHBondContact O-N 3.4Å; H77-S80 PolarHBondContact O-OG 2.97Å; Q78-S80 PolarHBondContact O-N 2.87Å
81	H	79.9	Confident	83.7	Confident	77 Å²	77	74.9 Å²	74.9	36%	0.356	42%	0.416	S	S	.	.	H	α-helix	trans	-89.4	-39.7	177.4	-59.5	-52.7	0	0	0	111.5	C61 E63 C64 H77 Q78 G83	C61-H81 PolarHBondContact SG-NE2 2.77Å; C61-H81 VanDerWaalsContact SG-NE2 3.45Å; E63-H81 WeakPolarHBondContact OE2-CB 3.45Å; E63-H81 IonicContact OE2-CD2 3.92Å; E63-H81 PolarHBondContact OE2-CD2 2.89Å; E63-H81 IonicContact OE2-CG 3.12Å; E63-H81 IonicContact OE2-NE2 2.96Å; C64-H81 PolarHBondContact SG-NE2 2.84Å; H77-H81 AromaticContact CE1-CE1 3.86Å; H77-H81 AromaticContact CE1-NE2 3.38Å; H77-H81 PolarHBondContact CE1-NE2 3.11Å; H77-H81 AromaticContact NE2-CD2 3.97Å; H77-H81 AromaticContact NE2-CE1 3.96Å; H77-H81 AromaticContact NE2-NE2 3.11Å; H77-H81 PolarHBondContact NE2-NE2 2.89Å; H77-H81 VanDerWaalsContact NE2-NE2 3.11Å; Q78-H81 PolarHBondContact O-N 3.05Å; H81-G83 PolarHBondContact O-N 3.48Å
82	T	79.7	Confident	83.9	Confident	83 Å²	83	74.6 Å²	74.6	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-74.1	-15.3	177.1	63.2	0	0	0	0	113.2	Q78 K79 E84	Q78-T82 PolarHBondContact O-N 3.07Å; K79-T82 WeakPolarHBondContact CA-OG1 3.41Å; T82-E84 PolarHBondContact O-N 3.03Å; T82-E84 WeakPolarHBondContact OG1-CG 3.39Å; T82-E84 PolarHBondContact OG1-N 3.48Å
83	G	77.9	Confident	84.1	Confident	48 Å²	48	72.3 Å²	72.3	50%	0.495	41%	0.405	S	S	.	.			trans	71.8	6.8	-176.7	0	0	0	0	0	114	K79 H81 K85	K79-G83 PolarHBondContact O-N 3.01Å; H81-G83 PolarHBondContact O-N 3.48Å; G83-K85 WeakPolarHBondContact O-CG 3.39Å; G83-K85 PolarHBondContact O-N 2.8Å
84	E	78.9	Confident	84.3	Confident	103 Å²	103	76.4 Å²	76.4	48%	0.481	42%	0.418	S	S	.	.			trans	-59	118.8	179.5	-78.1	179.3	-166.5	0	0	111.3	K79 T82 S97	K79-E84 PolarHBondContact O-N 3.46Å; T82-E84 PolarHBondContact O-N 3.03Å; T82-E84 WeakPolarHBondContact OG1-CG 3.39Å; T82-E84 PolarHBondContact OG1-N 3.48Å; E84-S97 WeakPolarHBondContact O-CB 3.37Å
85	K	85.1	Confident	84.6	Confident	126 Å²	126	77.2 Å²	77.2	55%	0.548	43%	0.427	S	S	.	.			trans	-128.2	75.1	178.9	-71.8	165.8	173.1	-176.8	0	110.2	G83 Y87 A95 F96	G83-K85 WeakPolarHBondContact O-CG 3.39Å; G83-K85 PolarHBondContact O-N 2.8Å; K85-Y87 PolarHBondContact O-N 2.89Å; K85-Y87 VanDerWaalsContact O-N 3.12Å; K85-A95 HydrophobicContact CB-CB 3.51Å; K85-A95 HydrophobicContact CD-CB 4.15Å; K85-A95 WeakPolarHBondContact CD-O 3.33Å; K85-A95 HydrophobicContact CG-CB 4.42Å; K85-F96 CarbonylContact C-O 3.58Å; K85-F96 VanDerWaalsContact C-O 3.24Å; K85-F96 VanDerWaalsContact CA-O 3.28Å; K85-F96 WeakPolarHBondContact CA-O 3.48Å
86	P	86.4	Confident	84.9	Confident	80 Å²	80	76.7 Å²	76.7	52%	0.519	42%	0.418	S	S	.	.			trans	-67.7	-12.5	-172.7	-21.1	34.7	0	0	0	114.7
87	Y	88.3	Confident	85.1	Confident	91 Å²	91	74.4 Å²	74.4	36%	0.357	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	99.9	-173	-56.3	-76.9	0	0	0	110.3	K85 A95 F96	K85-Y87 PolarHBondContact O-N 2.89Å; K85-Y87 VanDerWaalsContact O-N 3.12Å; Y87-A95 CarbonylContact O-C 3.5Å; Y87-A95 WeakPolarHBondContact O-CA 3.33Å; Y87-F96 WeakPolarHBondContact CB-O 3.37Å; Y87-F96 WeakPolarHBondContact CD2-O 3.27Å; Y87-F96 PolarHBondContact N-O 3.45Å; Y87-F96 VanDerWaalsContact N-O 3.1Å; Y87-F96 PolarHBondContact O-N 3.42Å
88	E	89.1	Confident	85.3	Confident	128 Å²	128	75.9 Å²	75.9	60%	0.598	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.4	-178.5	-168.1	175.3	169.6	0	0	112.7	S90 G93 A95	E88-S90 PolarHBondContact O-N 3.37Å; E88-G93 WeakPolarHBondContact OE1-CA 3.31Å; E88-A95 HydrophobicContact CB-CB 4.48Å; E88-A95 HydrophobicContact CG-CB 4.49Å
89	C	91.6	Very high	85.6	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.007	42%	0.419	C	S	.	.			trans	-81.7	112.5	172.1	-175.3	0	0	0	0	110	E91 C92 G93 K94 F96 L102 H105 H109	C89-E91 PolarHBondContact O-N 3.18Å; C89-E91 VanDerWaalsContact O-N 3.14Å; C89-C92 PolarHBondContact O-N 3.35Å; C89-C92 VanDerWaalsContact SG-SG 3.64Å; C89-G93 VanDerWaalsContact O-CA 3.31Å; C89-G93 WeakPolarHBondContact O-CA 3.31Å; C89-G93 PolarHBondContact O-N 2.84Å; C89-K94 HydrophobicContact CB-CB 4.48Å; C89-K94 VanDerWaalsContact CB-O 3.32Å; C89-K94 WeakPolarHBondContact CB-O 3.47Å; C89-K94 PolarHBondContact N-O 3.35Å; C89-F96 HydrophobicContact CB-CE2 4.4Å; C89-L102 HydrophobicContact CB-CD1 3.62Å; C89-H105 VanDerWaalsContact SG-CD2 3.57Å; C89-H109 PolarHBondContact SG-NE2 2.98Å; C89-H109 VanDerWaalsContact SG-NE2 3.43Å
90	S	88.6	Confident	85.9	Confident	111 Å²	111	74.6 Å²	74.6	78%	0.776	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.3	-179.9	52.6	0	0	0	0	114.5	E88	E88-S90 PolarHBondContact O-N 3.37Å
91	E	88.3	Confident	86.3	Confident	121 Å²	121	72.8 Å²	72.8	57%	0.565	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-26	-176.2	-65	-179.7	-160.9	0	0	113.9	C89 H109	C89-E91 PolarHBondContact O-N 3.18Å; C89-E91 VanDerWaalsContact O-N 3.14Å; E91-H109 WeakPolarHBondContact OE2-CB 3.4Å; E91-H109 IonicContact OE2-CD2 3.72Å; E91-H109 PolarHBondContact OE2-CD2 3.23Å; E91-H109 IonicContact OE2-CG 3.95Å; E91-H109 IonicContact OE2-ND1 3.87Å; E91-H109 IonicContact OE2-NE2 3.38Å
92	C	89.2	Confident	86.8	Confident	55 Å²	55	70.1 Å²	70.1	37%	0.372	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	5.4	-175.2	73.9	0	0	0	0	114.7	C89 K94 H105 H109	C89-C92 PolarHBondContact O-N 3.35Å; C89-C92 VanDerWaalsContact SG-SG 3.64Å; C92-K94 PolarHBondContact O-N 2.79Å; C92-K94 VanDerWaalsContact O-N 3.12Å; C92-H105 PolarHBondContact SG-NE2 3.22Å; C92-H109 PolarHBondContact SG-NE2 3.17Å
93	G	86.4	Confident	87.3	Confident	41 Å²	41	70.4 Å²	70.4	42%	0.423	40%	0.401	S	S	.	.			trans	66.5	7.4	179.6	0	0	0	0	0	114.8	E88 C89 A95	E88-G93 WeakPolarHBondContact OE1-CA 3.31Å; C89-G93 VanDerWaalsContact O-CA 3.31Å; C89-G93 WeakPolarHBondContact O-CA 3.31Å; C89-G93 PolarHBondContact O-N 2.84Å; G93-A95 PolarHBondContact O-N 3.32Å
94	K	87.9	Confident	87.8	Confident	126 Å²	126	71.9 Å²	71.9	55%	0.548	40%	0.395	S	S	.	.			trans	-75	123.5	-179.8	-75.4	-175.8	179.7	178.5	0	110.7	C89 C92 F96	C89-K94 HydrophobicContact CB-CB 4.48Å; C89-K94 VanDerWaalsContact CB-O 3.32Å; C89-K94 WeakPolarHBondContact CB-O 3.47Å; C89-K94 PolarHBondContact N-O 3.35Å; C92-K94 PolarHBondContact O-N 2.79Å; C92-K94 VanDerWaalsContact O-N 3.12Å; K94-F96 HydrophobicContact CB-CE2 3.97Å; K94-F96 HydrophobicContact CB-CZ 4.1Å; K94-F96 WeakPolarHBondContact O-CD2 3.44Å; K94-F96 VanDerWaalsContact O-CE2 3.24Å; K94-F96 WeakPolarHBondContact O-CE2 3.46Å
95	A	89.4	Confident	88.4	Confident	34 Å²	34	67.9 Å²	67.9	28%	0.281	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	143.4	179.3	0	0	0	0	0	113	K85 Y87 E88 G93	K85-A95 HydrophobicContact CB-CB 3.51Å; K85-A95 HydrophobicContact CD-CB 4.15Å; K85-A95 WeakPolarHBondContact CD-O 3.33Å; K85-A95 HydrophobicContact CG-CB 4.42Å; Y87-A95 CarbonylContact O-C 3.5Å; Y87-A95 WeakPolarHBondContact O-CA 3.33Å; E88-A95 HydrophobicContact CB-CB 4.48Å; E88-A95 HydrophobicContact CG-CB 4.49Å; G93-A95 PolarHBondContact O-N 3.32Å
96	F	88	Confident	88.6	Confident	44 Å²	44	65.2 Å²	65.2	19%	0.193	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.9	-177.1	-58.5	-89.6	0	0	0	110.9	K85 Y87 C89 K94 Q98 L102 H105	K85-F96 CarbonylContact C-O 3.58Å; K85-F96 VanDerWaalsContact C-O 3.24Å; K85-F96 VanDerWaalsContact CA-O 3.28Å; K85-F96 WeakPolarHBondContact CA-O 3.48Å; Y87-F96 WeakPolarHBondContact CB-O 3.37Å; Y87-F96 WeakPolarHBondContact CD2-O 3.27Å; Y87-F96 PolarHBondContact N-O 3.45Å; Y87-F96 VanDerWaalsContact N-O 3.1Å; Y87-F96 PolarHBondContact O-N 3.42Å; C89-F96 HydrophobicContact CB-CE2 4.4Å; K94-F96 HydrophobicContact CB-CE2 3.97Å; K94-F96 HydrophobicContact CB-CZ 4.1Å; K94-F96 WeakPolarHBondContact O-CD2 3.44Å; K94-F96 VanDerWaalsContact O-CE2 3.24Å; K94-F96 WeakPolarHBondContact O-CE2 3.46Å; F96-Q98 VanDerWaalsContact C-N 3.29Å; F96-L102 HydrophobicContact CB-CB 4.35Å; F96-L102 HydrophobicContact CD2-CB 3.84Å; F96-L102 HydrophobicContact CD2-CD1 3.72Å; F96-L102 HydrophobicContact CD2-CG 4.38Å; F96-L102 HydrophobicContact CE2-CD1 3.85Å; F96-L102 HydrophobicContact CG-CB 4.26Å; F96-H105 HydrophobicContact CE1-CB 3.94Å; F96-H105 HydrophobicContact CE2-CB 3.78Å; F96-H105 AromaticContact CE2-CD2 3.5Å; F96-H105 AromaticContact CE2-CG 3.61Å; F96-H105 HydrophobicContact CZ-CB 3.36Å; F96-H105 AromaticContact CZ-CD2 3.55Å; F96-H105 AromaticContact CZ-CG 3.19Å; F96-H105 AromaticContact CZ-ND1 3.66Å
97	S	86.5	Confident	88.8	Confident	41 Å²	41	64.1 Å²	64.1	29%	0.287	35%	0.351	S	S	.	.	S	Bend	trans	-79.7	-11.6	176.3	56.4	0	0	0	0	113.5	E84	E84-S97 WeakPolarHBondContact O-CB 3.37Å
98	Q	86.7	Confident	88.8	Confident	57 Å²	57	65.6 Å²	65.6	27%	0.266	36%	0.364	S	S	.	.	S	Bend	trans	-136	139.1	-178.5	-55.7	179.4	19.4	0	0	110.6	Q76 F96 S100 S101 L102	Q76-Q98 HydrophobicContact CG-CG 4.41Å; F96-Q98 VanDerWaalsContact C-N 3.29Å; Q98-S100 PolarHBondContact O-N 2.78Å; Q98-S101 WeakPolarHBondContact O-CB 3.4Å; Q98-S101 PolarHBondContact O-N 3.44Å; Q98-L102 PolarHBondContact O-N 3.22Å
99	S	88.3	Confident	88.8	Confident	56 Å²	56	63 Å²	63	39%	0.392	35%	0.351	S	S	.	.	H	α-helix	trans	-63.8	-38.3	177.6	57.2	0	0	0	0	112.7	S101 L102 I103	S99-S101 VanDerWaalsContact C-N 3.28Å; S99-S101 PolarHBondContact O-N 3.12Å; S99-L102 WeakPolarHBondContact O-CB 3.39Å; S99-L102 PolarHBondContact O-N 3.1Å; S99-L102 VanDerWaalsContact O-N 3.14Å; S99-I103 WeakPolarHBondContact O-CG1 3.37Å; S99-I103 PolarHBondContact O-N 3.48Å
100	S	88	Confident	88.7	Confident	67 Å²	67	66.7 Å²	66.7	47%	0.469	37%	0.374	S	S	.	.	H	α-helix	trans	-59.1	-38.2	176.2	54	0	0	0	0	112.6	Q98 I103 Q104	Q98-S100 PolarHBondContact O-N 2.78Å; S100-I103 PolarHBondContact O-N 3.03Å; S100-Q104 WeakPolarHBondContact O-CB 3.49Å; S100-Q104 PolarHBondContact O-N 3.04Å
101	S	88.9	Confident	88.6	Confident	39 Å²	39	63.5 Å²	63.5	27%	0.273	36%	0.359	S	S	.	.	H	α-helix	trans	-68.4	-38.8	175.6	-60.4	0	0	0	0	112	Q98 S99 Q104 H105	Q98-S101 WeakPolarHBondContact O-CB 3.4Å; Q98-S101 PolarHBondContact O-N 3.44Å; S99-S101 VanDerWaalsContact C-N 3.28Å; S99-S101 PolarHBondContact O-N 3.12Å; S101-Q104 PolarHBondContact O-N 3.17Å; S101-H105 VanDerWaalsContact O-CB 3.29Å; S101-H105 WeakPolarHBondContact O-CB 3.48Å; S101-H105 PolarHBondContact O-N 3.28Å
102	L	90.3	Very high	88.8	Confident	20 Å²	20	63 Å²	63	11%	0.105	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-47.8	173	173.4	62.4	0	0	0	111.3	C89 F96 Q98 S99 Q104 H105 Q106	C89-L102 HydrophobicContact CB-CD1 3.62Å; F96-L102 HydrophobicContact CB-CB 4.35Å; F96-L102 HydrophobicContact CD2-CB 3.84Å; F96-L102 HydrophobicContact CD2-CD1 3.72Å; F96-L102 HydrophobicContact CD2-CG 4.38Å; F96-L102 HydrophobicContact CE2-CD1 3.85Å; F96-L102 HydrophobicContact CG-CB 4.26Å; Q98-L102 PolarHBondContact O-N 3.22Å; S99-L102 WeakPolarHBondContact O-CB 3.39Å; S99-L102 PolarHBondContact O-N 3.1Å; S99-L102 VanDerWaalsContact O-N 3.14Å; L102-Q104 VanDerWaalsContact C-N 3.3Å; L102-Q104 PolarHBondContact O-N 2.95Å; L102-H105 CarbonylContact O-C 3.57Å; L102-H105 WeakPolarHBondContact O-CA 3.5Å; L102-H105 WeakPolarHBondContact O-CB 3.45Å; L102-H105 PolarHBondContact O-N 3.29Å; L102-Q106 HydrophobicContact CD1-CG 4.24Å; L102-Q106 WeakPolarHBondContact O-CG 3.19Å; L102-Q106 PolarHBondContact O-N 3.46Å
103	I	88.8	Confident	88.9	Confident	90 Å²	90	66.5 Å²	66.5	46%	0.462	37%	0.365	S	S	.	.	H	α-helix	trans	-59.7	-42.7	178	-67.2	165.8	0	0	0	110.7	S99 S100 H105 Q106	S99-I103 WeakPolarHBondContact O-CG1 3.37Å; S99-I103 PolarHBondContact O-N 3.48Å; S100-I103 PolarHBondContact O-N 3.03Å; I103-H105 VanDerWaalsContact C-N 3.32Å; I103-H105 PolarHBondContact O-N 3.4Å; I103-Q106 PolarHBondContact O-N 3.15Å
104	Q	89.9	Confident	89.1	Confident	79 Å²	79	68.2 Å²	68.2	37%	0.369	37%	0.369	S	S	.	.	H	α-helix	trans	-63.9	-38.9	174.9	178.9	178.5	80.1	0	0	112	S100 S101 L102 R107 Q126	S100-Q104 WeakPolarHBondContact O-CB 3.49Å; S100-Q104 PolarHBondContact O-N 3.04Å; S101-Q104 PolarHBondContact O-N 3.17Å; L102-Q104 VanDerWaalsContact C-N 3.3Å; L102-Q104 PolarHBondContact O-N 2.95Å; Q104-R107 WeakPolarHBondContact O-CB 3.33Å; Q104-R107 PolarHBondContact O-N 3.3Å; Q104-Q126 HydrophobicContact CG-CG 4.35Å; Q104-Q126 VanDerWaalsContact NE2-NE2 3.1Å
105	H	90.1	Very high	89.4	Confident	19 Å²	19	66 Å²	66	9%	0.088	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-41.2	177.5	170.4	70	0	0	0	112.4	C89 C92 F96 S101 L102 I103 R107 I108 H109	C89-H105 VanDerWaalsContact SG-CD2 3.57Å; C92-H105 PolarHBondContact SG-NE2 3.22Å; F96-H105 HydrophobicContact CE1-CB 3.94Å; F96-H105 HydrophobicContact CE2-CB 3.78Å; F96-H105 AromaticContact CE2-CD2 3.5Å; F96-H105 AromaticContact CE2-CG 3.61Å; F96-H105 HydrophobicContact CZ-CB 3.36Å; F96-H105 AromaticContact CZ-CD2 3.55Å; F96-H105 AromaticContact CZ-CG 3.19Å; F96-H105 AromaticContact CZ-ND1 3.66Å; S101-H105 VanDerWaalsContact O-CB 3.29Å; S101-H105 WeakPolarHBondContact O-CB 3.48Å; S101-H105 PolarHBondContact O-N 3.28Å; L102-H105 CarbonylContact O-C 3.57Å; L102-H105 WeakPolarHBondContact O-CA 3.5Å; L102-H105 WeakPolarHBondContact O-CB 3.45Å; L102-H105 PolarHBondContact O-N 3.29Å; I103-H105 VanDerWaalsContact C-N 3.32Å; I103-H105 PolarHBondContact O-N 3.4Å; H105-R107 PolarHBondContact O-N 3.18Å; H105-R107 VanDerWaalsContact O-N 3.11Å; H105-I108 VanDerWaalsContact O-CB 3.23Å; H105-I108 WeakPolarHBondContact O-CB 3.35Å; H105-I108 VanDerWaalsContact O-CG1 3.31Å; H105-I108 WeakPolarHBondContact O-CG1 3.46Å; H105-I108 PolarHBondContact O-N 3.48Å; H105-H109 AromaticContact NE2-NE2 3.49Å; H105-H109 PolarHBondContact NE2-NE2 3.2Å
106	Q	89.3	Confident	89.6	Confident	69 Å²	69	71.3 Å²	71.3	32%	0.322	37%	0.374	S	S	.	.	H	α-helix	trans	-56.4	-29.2	178.3	-75.9	171.7	-29.2	0	0	112.6	L102 I103 I108 H109 T110	L102-Q106 HydrophobicContact CD1-CG 4.24Å; L102-Q106 WeakPolarHBondContact O-CG 3.19Å; L102-Q106 PolarHBondContact O-N 3.46Å; I103-Q106 PolarHBondContact O-N 3.15Å; Q106-I108 PolarHBondContact O-N 2.81Å; Q106-I108 VanDerWaalsContact O-N 3.1Å; Q106-H109 PolarHBondContact O-N 3.34Å; Q106-T110 PolarHBondContact O-N 2.78Å; Q106-T110 VanDerWaalsContact O-N 3.12Å
107	R	91.3	Very high	89.9	Confident	57 Å²	57	69.3 Å²	69.3	22%	0.215	37%	0.366	C	S	.	.	H	α-helix	trans	-60.9	-18.5	173.8	-61.9	-177.3	-179.7	157.8	6.8	114.4	Q104 H105 H109 T110 G111 E112 S125	Q104-R107 WeakPolarHBondContact O-CB 3.33Å; Q104-R107 PolarHBondContact O-N 3.3Å; H105-R107 PolarHBondContact O-N 3.18Å; H105-R107 VanDerWaalsContact O-N 3.11Å; R107-H109 VanDerWaalsContact C-N 3.31Å; R107-T110 WeakPolarHBondContact CA-OG1 3.31Å; R107-G111 WeakPolarHBondContact O-CA 2.99Å; R107-G111 PolarHBondContact O-N 3.5Å; R107-G111 VanDerWaalsContact O-N 3.08Å; R107-E112 HydrophobicContact CB-CB 4.44Å; R107-E112 HydrophobicContact CG-CB 4.23Å; R107-E112 PolarHBondContact O-N 3.11Å; R107-S125 PolarHBondContact NH1-O 3.09Å
108	I	88.5	Confident	90.1	Very high	122 Å²	122	72.4 Å²	72.4	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-68.5	-37.1	174.3	-61.8	176.6	0	0	0	110.1	H105 Q106	H105-I108 VanDerWaalsContact O-CB 3.23Å; H105-I108 WeakPolarHBondContact O-CB 3.35Å; H105-I108 VanDerWaalsContact O-CG1 3.31Å; H105-I108 WeakPolarHBondContact O-CG1 3.46Å; H105-I108 PolarHBondContact O-N 3.48Å; Q106-I108 PolarHBondContact O-N 2.81Å; Q106-I108 VanDerWaalsContact O-N 3.1Å
109	H	89.2	Confident	90.4	Very high	74 Å²	74	75.4 Å²	75.4	34%	0.343	40%	0.401	S	S	.	.	H	α-helix	trans	-84.7	-43.6	-177.7	-54.4	-49.8	0	0	0	112.2	C89 E91 C92 H105 Q106 R107 G111	C89-H109 PolarHBondContact SG-NE2 2.98Å; C89-H109 VanDerWaalsContact SG-NE2 3.43Å; E91-H109 WeakPolarHBondContact OE2-CB 3.4Å; E91-H109 IonicContact OE2-CD2 3.72Å; E91-H109 PolarHBondContact OE2-CD2 3.23Å; E91-H109 IonicContact OE2-CG 3.95Å; E91-H109 IonicContact OE2-ND1 3.87Å; E91-H109 IonicContact OE2-NE2 3.38Å; C92-H109 PolarHBondContact SG-NE2 3.17Å; H105-H109 AromaticContact NE2-NE2 3.49Å; H105-H109 PolarHBondContact NE2-NE2 3.2Å; Q106-H109 PolarHBondContact O-N 3.34Å; R107-H109 VanDerWaalsContact C-N 3.31Å; H109-G111 PolarHBondContact O-N 2.77Å
110	T	88.1	Confident	90.6	Very high	79 Å²	79	75.7 Å²	75.7	49%	0.485	40%	0.403	S	S	.	.	H	α-helix	trans	-72.5	-17.1	177.3	65.7	0	0	0	0	112.8	Q106 R107 E112	Q106-T110 PolarHBondContact O-N 2.78Å; Q106-T110 VanDerWaalsContact O-N 3.12Å; R107-T110 WeakPolarHBondContact CA-OG1 3.31Å; T110-E112 PolarHBondContact O-N 2.88Å; T110-E112 WeakPolarHBondContact OG1-CB 3.38Å; T110-E112 WeakPolarHBondContact OG1-CG 3.35Å; T110-E112 PolarHBondContact OG1-N 2.9Å
111	G	88	Confident	90.7	Very high	44 Å²	44	74.2 Å²	74.2	45%	0.454	40%	0.398	S	S	.	.			trans	70.8	6.1	-175.2	0	0	0	0	0	114.1	R107 H109 K113	R107-G111 WeakPolarHBondContact O-CA 2.99Å; R107-G111 PolarHBondContact O-N 3.5Å; R107-G111 VanDerWaalsContact O-N 3.08Å; H109-G111 PolarHBondContact O-N 2.77Å; G111-K113 PolarHBondContact O-N 3.1Å
112	E	91	Very high	90.8	Very high	111 Å²	111	80.1 Å²	80.1	52%	0.519	42%	0.415	S	S	.	.			trans	-58.3	125.1	-178	-80.7	-176.1	-177.3	0	0	112.3	R107 T110	R107-E112 HydrophobicContact CB-CB 4.44Å; R107-E112 HydrophobicContact CG-CB 4.23Å; R107-E112 PolarHBondContact O-N 3.11Å; T110-E112 PolarHBondContact O-N 2.88Å; T110-E112 WeakPolarHBondContact OG1-CB 3.38Å; T110-E112 WeakPolarHBondContact OG1-CG 3.35Å; T110-E112 PolarHBondContact OG1-N 2.9Å
113	K	91.6	Very high	91	Very high	128 Å²	128	80.6 Å²	80.6	56%	0.557	42%	0.421	S	S	*	.			trans	-128.9	76.6	178.5	-74	164.8	178.1	174.6	0	110.2	G111 Y115 A123 F124	G111-K113 PolarHBondContact O-N 3.1Å; K113-Y115 PolarHBondContact O-N 3.28Å; K113-Y115 VanDerWaalsContact O-N 3.12Å; K113-A123 HydrophobicContact CB-CB 3.54Å; K113-A123 HydrophobicContact CD-CB 4.32Å; K113-A123 WeakPolarHBondContact CD-O 3.28Å; K113-A123 HydrophobicContact CG-CB 4.49Å; K113-F124 CarbonylContact C-O 3.52Å; K113-F124 VanDerWaalsContact C-O 3.26Å; K113-F124 WeakPolarHBondContact CA-O 3.35Å
114	P	91.7	Very high	91.1	Very high	76 Å²	76	77.9 Å²	77.9	49%	0.494	41%	0.406	S	S	.	.			trans	-63.6	-21.5	-172.9	-23.3	34.9	0	0	0	114.1
115	Y	93.9	Very high	91.2	Very high	81 Å²	81	75.8 Å²	75.8	32%	0.318	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	96.9	-171.7	-56	-79.8	0	0	0	110.6	K113 A123 F124 Q126 N127	K113-Y115 PolarHBondContact O-N 3.28Å; K113-Y115 VanDerWaalsContact O-N 3.12Å; Y115-A123 CarbonylContact O-C 3.55Å; Y115-A123 WeakPolarHBondContact O-CA 3.28Å; Y115-F124 WeakPolarHBondContact CB-O 3.49Å; Y115-F124 WeakPolarHBondContact CD2-O 3.37Å; Y115-F124 PolarHBondContact N-O 3.45Å; Y115-F124 VanDerWaalsContact N-O 3.07Å; Y115-F124 PolarHBondContact O-N 3.39Å; Y115-Q126 VanDerWaalsContact CD2-C 3.42Å; Y115-N127 HydrophobicContact CD1-CB 3.72Å; Y115-N127 HydrophobicContact CE1-CB 3.56Å; Y115-N127 HydrophobicContact CE2-CB 4.39Å; Y115-N127 HydrophobicContact CG-CB 4.2Å
116	K	93.1	Very high	91.2	Very high	145 Å²	145	77.8 Å²	77.8	63%	0.63	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	135	-178.3	-164.4	176.8	-179	-179.3	0	112	G121 A123	K116-G121 VanDerWaalsContact CE-O 3.25Å; K116-G121 WeakPolarHBondContact CE-O 3.42Å; K116-G121 WeakPolarHBondContact CG-O 3.44Å; K116-A123 HydrophobicContact CB-CB 4.41Å; K116-A123 HydrophobicContact CG-CB 4.36Å
117	C	94.1	Very high	91.3	Very high	1 Å²	1	78.4 Å²	78.4	1%	0.007	42%	0.415	C	S	.	.			trans	-76	124.9	169.6	-177.4	0	0	0	0	109.7	E119 C120 G121 R122 L130 H137	C117-E119 VanDerWaalsContact C-N 3.31Å; C117-E119 PolarHBondContact O-N 3.12Å; C117-C120 VanDerWaalsContact SG-SG 3.62Å; C117-G121 WeakPolarHBondContact O-CA 3.46Å; C117-G121 PolarHBondContact O-N 3.13Å; C117-R122 VanDerWaalsContact CB-O 3.28Å; C117-R122 WeakPolarHBondContact CB-O 3.41Å; C117-R122 PolarHBondContact N-O 3.48Å; C117-L130 HydrophobicContact CB-CD1 3.67Å; C117-H137 PolarHBondContact SG-NE2 3.05Å; C117-H137 VanDerWaalsContact SG-NE2 3.4Å
118	S	91.9	Very high	91.2	Very high	107 Å²	107	78.3 Å²	78.3	75%	0.748	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.2	177.6	46.5	0	0	0	0	113.1
119	E	91.4	Very high	91.3	Very high	119 Å²	119	75.5 Å²	75.5	56%	0.556	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-38.1	-172.5	-65.1	174.1	-150.3	0	0	113.5	C117 H137	C117-E119 VanDerWaalsContact C-N 3.31Å; C117-E119 PolarHBondContact O-N 3.12Å; E119-H137 WeakPolarHBondContact OE2-CB 3.48Å; E119-H137 IonicContact OE2-CD2 3.89Å; E119-H137 PolarHBondContact OE2-CD2 2.91Å; E119-H137 IonicContact OE2-CG 3.94Å
120	C	92.6	Very high	91.5	Very high	63 Å²	63	72.6 Å²	72.6	43%	0.426	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	2.6	-177.4	71.6	0	0	0	0	113.9	C117 R122 H133	C117-C120 VanDerWaalsContact SG-SG 3.62Å; C120-R122 PolarHBondContact O-N 3.19Å; C120-R122 WeakPolarHBondContact SG-CB 3.38Å; C120-H133 PolarHBondContact SG-NE2 3.12Å
121	G	90.1	Very high	91.6	Very high	36 Å²	36	71.5 Å²	71.5	37%	0.371	39%	0.393	S	S	.	.			trans	70.4	-3.2	-179.4	0	0	0	0	0	115.4	K116 C117	K116-G121 VanDerWaalsContact CE-O 3.25Å; K116-G121 WeakPolarHBondContact CE-O 3.42Å; K116-G121 WeakPolarHBondContact CG-O 3.44Å; C117-G121 WeakPolarHBondContact O-CA 3.46Å; C117-G121 PolarHBondContact O-N 3.13Å
122	R	92.6	Very high	91.6	Very high	163 Å²	163	73.3 Å²	73.3	62%	0.615	39%	0.389	S	S	*	.			trans	-69.1	132.9	-177	-164.6	172.2	-175.5	174.3	2.8	111.2	C117 C120 F124	C117-R122 VanDerWaalsContact CB-O 3.28Å; C117-R122 WeakPolarHBondContact CB-O 3.41Å; C117-R122 PolarHBondContact N-O 3.48Å; C120-R122 PolarHBondContact O-N 3.19Å; C120-R122 WeakPolarHBondContact SG-CB 3.38Å; R122-F124 HydrophobicContact CB-CE2 4.26Å; R122-F124 HydrophobicContact CB-CZ 4.42Å; R122-F124 HydrophobicContact CG-CE2 4.19Å; R122-F124 HydrophobicContact CG-CZ 3.97Å; R122-F124 WeakPolarHBondContact O-CE2 3.4Å
123	A	93.3	Very high	91.6	Very high	30 Å²	30	69.2 Å²	69.2	25%	0.248	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	148.8	-176.3	0	0	0	0	0	113	K113 Y115 K116	K113-A123 HydrophobicContact CB-CB 3.54Å; K113-A123 HydrophobicContact CD-CB 4.32Å; K113-A123 WeakPolarHBondContact CD-O 3.28Å; K113-A123 HydrophobicContact CG-CB 4.49Å; Y115-A123 CarbonylContact O-C 3.55Å; Y115-A123 WeakPolarHBondContact O-CA 3.28Å; K116-A123 HydrophobicContact CB-CB 4.41Å; K116-A123 HydrophobicContact CG-CB 4.36Å
124	F	92.3	Very high	91.6	Very high	33 Å²	33	66.3 Å²	66.3	15%	0.145	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.8	-175.8	-57.5	-91.8	0	0	0	110.8	K113 Y115 R122 Q126 N129 L130 H133	K113-F124 CarbonylContact C-O 3.52Å; K113-F124 VanDerWaalsContact C-O 3.26Å; K113-F124 WeakPolarHBondContact CA-O 3.35Å; Y115-F124 WeakPolarHBondContact CB-O 3.49Å; Y115-F124 WeakPolarHBondContact CD2-O 3.37Å; Y115-F124 PolarHBondContact N-O 3.45Å; Y115-F124 VanDerWaalsContact N-O 3.07Å; Y115-F124 PolarHBondContact O-N 3.39Å; R122-F124 HydrophobicContact CB-CE2 4.26Å; R122-F124 HydrophobicContact CB-CZ 4.42Å; R122-F124 HydrophobicContact CG-CE2 4.19Å; R122-F124 HydrophobicContact CG-CZ 3.97Å; R122-F124 WeakPolarHBondContact O-CE2 3.4Å; F124-Q126 VanDerWaalsContact C-N 3.27Å; F124-Q126 PolarHBondContact O-N 2.95Å; F124-N129 HydrophobicContact CB-CB 4.27Å; F124-N129 HydrophobicContact CD1-CB 3.88Å; F124-N129 HydrophobicContact CG-CB 4.31Å; F124-L130 HydrophobicContact CB-CB 4.35Å; F124-L130 HydrophobicContact CD2-CB 3.82Å; F124-L130 HydrophobicContact CD2-CD1 3.76Å; F124-L130 HydrophobicContact CD2-CG 4.4Å; F124-L130 HydrophobicContact CE2-CD1 3.87Å; F124-L130 HydrophobicContact CG-CB 4.25Å; F124-H133 HydrophobicContact CE1-CB 3.98Å; F124-H133 HydrophobicContact CE2-CB 3.86Å; F124-H133 AromaticContact CE2-CD2 3.36Å; F124-H133 WeakPolarHBondContact CE2-CD2 3.27Å; F124-H133 AromaticContact CE2-CG 3.71Å; F124-H133 HydrophobicContact CZ-CB 3.39Å; F124-H133 AromaticContact CZ-CD2 3.38Å; F124-H133 WeakPolarHBondContact CZ-CD2 3.49Å; F124-H133 AromaticContact CZ-CG 3.27Å
125	S	91.1	Very high	91.6	Very high	35 Å²	35	64.5 Å²	64.5	25%	0.245	34%	0.341	C	S	.	.	S	Bend	trans	-77.6	-13.6	176.2	55.9	0	0	0	0	113.2	R107	R107-S125 PolarHBondContact NH1-O 3.09Å
126	Q	90.9	Very high	91.5	Very high	60 Å²	60	64.8 Å²	64.8	28%	0.28	35%	0.352	S	S	.	.	S	Bend	trans	-136.9	138.2	-178.4	-52.8	-176.7	20.7	0	0	111.3	Q104 Y115 F124 A128 N129 L130	Q104-Q126 HydrophobicContact CG-CG 4.35Å; Q104-Q126 VanDerWaalsContact NE2-NE2 3.1Å; Y115-Q126 VanDerWaalsContact CD2-C 3.42Å; F124-Q126 VanDerWaalsContact C-N 3.27Å; F124-Q126 PolarHBondContact O-N 2.95Å; Q126-A128 VanDerWaalsContact C-N 3.32Å; Q126-A128 PolarHBondContact O-N 3.4Å; Q126-N129 PolarHBondContact O-N 3.18Å; Q126-L130 PolarHBondContact O-N 3.38Å
127	N	90.7	Very high	91.3	Very high	82 Å²	82	61.3 Å²	61.3	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-61.7	-38.5	179.4	-170.2	46.9	0	0	0	113	Y115 N129 L130 T131	Y115-N127 HydrophobicContact CD1-CB 3.72Å; Y115-N127 HydrophobicContact CE1-CB 3.56Å; Y115-N127 HydrophobicContact CE2-CB 4.39Å; Y115-N127 HydrophobicContact CG-CB 4.2Å; N127-N129 PolarHBondContact O-N 3.03Å; N127-L130 WeakPolarHBondContact O-CB 3.4Å; N127-L130 PolarHBondContact O-N 3.34Å; N127-L130 VanDerWaalsContact O-N 3.12Å; N127-T131 PolarHBondContact O-N 3.24Å; N127-T131 PolarHBondContact O-OG1 3.4Å; N127-T131 VanDerWaalsContact O-OG1 3.07Å
128	A	88.6	Confident	91.1	Very high	55 Å²	55	65.7 Å²	65.7	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-58.9	-37	178.7	0	0	0	0	0	112	Q126 T131 K132	Q126-A128 VanDerWaalsContact C-N 3.32Å; Q126-A128 PolarHBondContact O-N 3.4Å; A128-T131 PolarHBondContact O-N 3.39Å; A128-K132 WeakPolarHBondContact O-CG 2.92Å; A128-K132 PolarHBondContact O-N 2.82Å
129	N	91	Very high	91	Very high	64 Å²	64	62.9 Å²	62.9	34%	0.342	35%	0.352	S	S	.	.	H	α-helix	trans	-71.2	-38.6	176.9	-67.6	-22.2	0	0	0	111.8	F124 Q126 N127 K132 H133	F124-N129 HydrophobicContact CB-CB 4.27Å; F124-N129 HydrophobicContact CD1-CB 3.88Å; F124-N129 HydrophobicContact CG-CB 4.31Å; Q126-N129 PolarHBondContact O-N 3.18Å; N127-N129 PolarHBondContact O-N 3.03Å; N129-K132 PolarHBondContact O-N 3.42Å; N129-H133 VanDerWaalsContact O-CB 3.29Å; N129-H133 WeakPolarHBondContact O-CB 3.45Å; N129-H133 PolarHBondContact O-N 3.01Å
130	L	92.6	Very high	91	Very high	13 Å²	13	61.3 Å²	61.3	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-46.2	171.4	173.3	62.8	0	0	0	111	C117 F124 Q126 N127 K132 H133 Q134	C117-L130 HydrophobicContact CB-CD1 3.67Å; F124-L130 HydrophobicContact CB-CB 4.35Å; F124-L130 HydrophobicContact CD2-CB 3.82Å; F124-L130 HydrophobicContact CD2-CD1 3.76Å; F124-L130 HydrophobicContact CD2-CG 4.4Å; F124-L130 HydrophobicContact CE2-CD1 3.87Å; F124-L130 HydrophobicContact CG-CB 4.25Å; Q126-L130 PolarHBondContact O-N 3.38Å; N127-L130 WeakPolarHBondContact O-CB 3.4Å; N127-L130 PolarHBondContact O-N 3.34Å; N127-L130 VanDerWaalsContact O-N 3.12Å; L130-K132 PolarHBondContact O-N 3.45Å; L130-H133 CarbonylContact O-C 3.23Å; L130-H133 WeakPolarHBondContact O-CA 3.46Å; L130-H133 WeakPolarHBondContact O-CB 3.4Å; L130-H133 PolarHBondContact O-N 3.32Å; L130-H133 VanDerWaalsContact O-N 3.1Å; L130-Q134 HydrophobicContact CD1-CG 4.23Å; L130-Q134 WeakPolarHBondContact O-CG 3.38Å; L130-Q134 PolarHBondContact O-N 3.3Å
131	T	90.2	Very high	90.9	Very high	56 Å²	56	64 Å²	64	34%	0.344	35%	0.349	S	S	.	.	H	α-helix	trans	-61.1	-44.8	178.9	-55.5	0	0	0	0	111.3	N127 A128 H133 Q134	N127-T131 PolarHBondContact O-N 3.24Å; N127-T131 PolarHBondContact O-OG1 3.4Å; N127-T131 VanDerWaalsContact O-OG1 3.07Å; A128-T131 PolarHBondContact O-N 3.39Å; T131-H133 VanDerWaalsContact C-N 3.3Å; T131-H133 PolarHBondContact O-N 2.9Å; T131-Q134 PolarHBondContact O-N 2.92Å
132	K	89.5	Confident	90.9	Very high	82 Å²	82	63.1 Å²	63.1	36%	0.357	34%	0.336	S	S	.	.	H	α-helix	trans	-62.1	-39.6	174	-72.6	-174.6	-173.7	-158.8	0	111.7	A128 N129 L130 R135 D154	A128-K132 WeakPolarHBondContact O-CG 2.92Å; A128-K132 PolarHBondContact O-N 2.82Å; N129-K132 PolarHBondContact O-N 3.42Å; L130-K132 PolarHBondContact O-N 3.45Å; K132-R135 WeakPolarHBondContact O-CB 3.38Å; K132-R135 PolarHBondContact O-N 3.4Å; K132-D154 WeakPolarHBondContact CE-OD1 3.26Å; K132-D154 IonicContact NZ-OD1 2.98Å; K132-D154 PolarHBondContact NZ-OD1 2.84Å; K132-D154 IonicContact NZ-OD2 2.78Å; K132-D154 PolarHBondContact NZ-OD2 2.95Å
133	H	91.4	Very high	90.9	Very high	24 Å²	24	56.8 Å²	56.8	11%	0.111	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-41	177.2	170.3	56.4	0	0	0	112.4	C120 F124 N129 L130 T131 R135 T136 H137	C120-H133 PolarHBondContact SG-NE2 3.12Å; F124-H133 HydrophobicContact CE1-CB 3.98Å; F124-H133 HydrophobicContact CE2-CB 3.86Å; F124-H133 AromaticContact CE2-CD2 3.36Å; F124-H133 WeakPolarHBondContact CE2-CD2 3.27Å; F124-H133 AromaticContact CE2-CG 3.71Å; F124-H133 HydrophobicContact CZ-CB 3.39Å; F124-H133 AromaticContact CZ-CD2 3.38Å; F124-H133 WeakPolarHBondContact CZ-CD2 3.49Å; F124-H133 AromaticContact CZ-CG 3.27Å; N129-H133 VanDerWaalsContact O-CB 3.29Å; N129-H133 WeakPolarHBondContact O-CB 3.45Å; N129-H133 PolarHBondContact O-N 3.01Å; L130-H133 CarbonylContact O-C 3.23Å; L130-H133 WeakPolarHBondContact O-CA 3.46Å; L130-H133 WeakPolarHBondContact O-CB 3.4Å; L130-H133 PolarHBondContact O-N 3.32Å; L130-H133 VanDerWaalsContact O-N 3.1Å; T131-H133 VanDerWaalsContact C-N 3.3Å; T131-H133 PolarHBondContact O-N 2.9Å; H133-R135 PolarHBondContact O-N 3.31Å; H133-R135 VanDerWaalsContact O-N 3.09Å; H133-T136 PolarHBondContact ND1-OG1 3.24Å; H133-T136 WeakPolarHBondContact O-CB 3.47Å; H133-T136 WeakPolarHBondContact O-CG2 3.24Å; H133-T136 PolarHBondContact O-N 3.43Å; H133-T136 PolarHBondContact O-OG1 2.9Å; H133-H137 AromaticContact CE1-CE1 3.84Å; H133-H137 AromaticContact CE1-NE2 3.58Å; H133-H137 AromaticContact NE2-CE1 3.9Å; H133-H137 AromaticContact NE2-NE2 3.24Å; H133-H137 PolarHBondContact NE2-NE2 2.92Å
134	Q	91.1	Very high	90.8	Very high	68 Å²	68	63.8 Å²	63.8	32%	0.318	33%	0.333	S	S	.	.	H	α-helix	trans	-56.6	-29.7	178.5	-75.8	169.8	-37.9	0	0	112.6	L130 T131 T136 H137 T138	L130-Q134 HydrophobicContact CD1-CG 4.23Å; L130-Q134 WeakPolarHBondContact O-CG 3.38Å; L130-Q134 PolarHBondContact O-N 3.3Å; T131-Q134 PolarHBondContact O-N 2.92Å; Q134-T136 PolarHBondContact O-N 3.36Å; Q134-T136 VanDerWaalsContact O-N 3.17Å; Q134-H137 PolarHBondContact O-N 2.88Å; Q134-T138 PolarHBondContact O-N 3.09Å
135	R	91.9	Very high	90.8	Very high	37 Å²	37	62.7 Å²	62.7	14%	0.14	33%	0.329	C	S	.	.	H	α-helix	trans	-61.4	-21	172.8	-60.7	-178.5	179.6	152.5	5.7	114.1	K132 H133 H137 T138 G139 E140 S153	K132-R135 WeakPolarHBondContact O-CB 3.38Å; K132-R135 PolarHBondContact O-N 3.4Å; H133-R135 PolarHBondContact O-N 3.31Å; H133-R135 VanDerWaalsContact O-N 3.09Å; R135-H137 VanDerWaalsContact C-N 3.27Å; R135-T138 WeakPolarHBondContact CA-OG1 3.42Å; R135-G139 WeakPolarHBondContact O-CA 3.36Å; R135-G139 PolarHBondContact O-N 3.3Å; R135-E140 HydrophobicContact CB-CB 4.44Å; R135-E140 HydrophobicContact CG-CB 4.33Å; R135-E140 IonicContact NE-OE2 3.44Å; R135-E140 PolarHBondContact O-N 2.99Å; R135-S153 WeakPolarHBondContact CD-O 3.18Å; R135-S153 PolarHBondContact NH1-O 3.15Å
136	T	90.3	Very high	90.8	Very high	88 Å²	88	66 Å²	66	54%	0.54	35%	0.352	S	S	.	.	H	α-helix	trans	-71.9	-25.5	175.6	68.2	0	0	0	0	112.4	H133 Q134	H133-T136 PolarHBondContact ND1-OG1 3.24Å; H133-T136 WeakPolarHBondContact O-CB 3.47Å; H133-T136 WeakPolarHBondContact O-CG2 3.24Å; H133-T136 PolarHBondContact O-N 3.43Å; H133-T136 PolarHBondContact O-OG1 2.9Å; Q134-T136 PolarHBondContact O-N 3.36Å; Q134-T136 VanDerWaalsContact O-N 3.17Å
137	H	90.3	Very high	90.7	Very high	72 Å²	72	68.3 Å²	68.3	33%	0.333	36%	0.363	S	S	.	.	H	α-helix	trans	-88.1	-41.7	177.6	-55.6	-49.6	0	0	0	111.8	C117 E119 H133 Q134 R135 G139	C117-H137 PolarHBondContact SG-NE2 3.05Å; C117-H137 VanDerWaalsContact SG-NE2 3.4Å; E119-H137 WeakPolarHBondContact OE2-CB 3.48Å; E119-H137 IonicContact OE2-CD2 3.89Å; E119-H137 PolarHBondContact OE2-CD2 2.91Å; E119-H137 IonicContact OE2-CG 3.94Å; H133-H137 AromaticContact CE1-CE1 3.84Å; H133-H137 AromaticContact CE1-NE2 3.58Å; H133-H137 AromaticContact NE2-CE1 3.9Å; H133-H137 AromaticContact NE2-NE2 3.24Å; H133-H137 PolarHBondContact NE2-NE2 2.92Å; Q134-H137 PolarHBondContact O-N 2.88Å; R135-H137 VanDerWaalsContact C-N 3.27Å; H137-G139 VanDerWaalsContact C-N 3.27Å; H137-G139 PolarHBondContact O-N 3.17Å
138	T	89.7	Confident	90.8	Very high	93 Å²	93	66.3 Å²	66.3	57%	0.571	36%	0.355	S	S	*	.	H	α-helix	trans	-75.5	-16.9	177.7	65.1	0	0	0	0	113.3	Q134 R135 E140	Q134-T138 PolarHBondContact O-N 3.09Å; R135-T138 WeakPolarHBondContact CA-OG1 3.42Å; T138-E140 PolarHBondContact O-N 3.34Å; T138-E140 WeakPolarHBondContact OG1-CB 3.47Å; T138-E140 PolarHBondContact OG1-N 3.48Å
139	G	89.2	Confident	90.8	Very high	47 Å²	47	73.5 Å²	73.5	49%	0.485	38%	0.379	S	S	.	.			trans	70.5	7.8	-172.9	0	0	0	0	0	114	R135 H137 K141	R135-G139 WeakPolarHBondContact O-CA 3.36Å; R135-G139 PolarHBondContact O-N 3.3Å; H137-G139 VanDerWaalsContact C-N 3.27Å; H137-G139 PolarHBondContact O-N 3.17Å; G139-K141 PolarHBondContact O-N 2.88Å
140	E	91.1	Very high	90.7	Very high	87 Å²	87	76.4 Å²	76.4	41%	0.407	39%	0.389	S	S	.	.			trans	-61.3	123.8	-177.8	-167.1	-164.2	171	0	0	110.7	R135 T138 P142	R135-E140 HydrophobicContact CB-CB 4.44Å; R135-E140 HydrophobicContact CG-CB 4.33Å; R135-E140 IonicContact NE-OE2 3.44Å; R135-E140 PolarHBondContact O-N 2.99Å; T138-E140 PolarHBondContact O-N 3.34Å; T138-E140 WeakPolarHBondContact OG1-CB 3.47Å; T138-E140 PolarHBondContact OG1-N 3.48Å; E140-P142 HydrophobicContact CG-CG 3.94Å; E140-P142 WeakPolarHBondContact O-CD 3.35Å; E140-P142 WeakPolarHBondContact OE1-CG 3.3Å
141	K	91.3	Very high	90.7	Very high	120 Å²	120	77 Å²	77	52%	0.522	40%	0.395	S	S	.	.			trans	-125.6	78.7	179.1	-73	166.9	170.4	-173.5	0	110.3	G139 Y143 A151 F152	G139-K141 PolarHBondContact O-N 2.88Å; K141-Y143 PolarHBondContact O-N 2.93Å; K141-A151 HydrophobicContact CB-CB 3.57Å; K141-A151 HydrophobicContact CD-CB 4.23Å; K141-A151 WeakPolarHBondContact CD-O 3.38Å; K141-A151 HydrophobicContact CG-CB 4.46Å; K141-F152 CarbonylContact C-O 3.51Å; K141-F152 VanDerWaalsContact C-O 3.25Å; K141-F152 VanDerWaalsContact CA-O 3.3Å; K141-F152 WeakPolarHBondContact CA-O 3.42Å
142	P	91	Very high	90.7	Very high	16 Å²	16	76.3 Å²	76.3	10%	0.104	39%	0.388	C	S	.	.			trans	-67.1	-18.6	-171.6	-21.1	33.8	0	0	0	114.5	R36 E140	R36-P142 PolarHBondContact N-O 2.75Å; E140-P142 HydrophobicContact CG-CG 3.94Å; E140-P142 WeakPolarHBondContact O-CD 3.35Å; E140-P142 WeakPolarHBondContact OE1-CG 3.3Å
143	Y	91.8	Very high	90.8	Very high	31 Å²	31	74.4 Å²	74.4	12%	0.122	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	101.9	-171.4	-56	-79.7	0	0	0	109.7	R36 K141 A151 F152 D154 C155	R36-Y143 HydrophobicContact CB-CD1 4.14Å; R36-Y143 HydrophobicContact CB-CE1 3.93Å; K141-Y143 PolarHBondContact O-N 2.93Å; Y143-A151 CarbonylContact O-C 3.24Å; Y143-A151 WeakPolarHBondContact O-CA 3.49Å; Y143-F152 WeakPolarHBondContact CD2-O 2.87Å; Y143-F152 PolarHBondContact N-O 3.4Å; Y143-F152 VanDerWaalsContact N-O 3.13Å; Y143-F152 PolarHBondContact O-N 3.2Å; Y143-D154 VanDerWaalsContact CD2-C 3.43Å; Y143-C155 HydrophobicContact CD1-CB 3.93Å; Y143-C155 HydrophobicContact CE1-CB 3.68Å; Y143-C155 HydrophobicContact CE2-CB 4.44Å; Y143-C155 HydrophobicContact CG-CB 4.4Å
144	R	91.1	Very high	90.6	Very high	176 Å²	176	75.1 Å²	75.1	66%	0.664	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	139.3	179.1	-64.2	-171	178	174.1	0	111	A151	R144-A151 HydrophobicContact CG-CB 3.93Å
145	C	91.9	Very high	90.5	Very high	10 Å²	10	72.8 Å²	72.8	7%	0.068	38%	0.381	C	S	.	.			trans	-69.9	139.2	166	-172.5	0	0	0	0	109.3	E147 C148 K150 L158	C145-E147 PolarHBondContact SG-N 3.3Å; C145-E147 VanDerWaalsContact SG-N 3.44Å; C145-C148 CarbonylContact C-O 3.25Å; C145-C148 WeakPolarHBondContact CB-O 3.14Å; C145-K150 WeakPolarHBondContact CB-O 3.27Å; C145-K150 PolarHBondContact N-O 3.03Å; C145-L158 HydrophobicContact CB-CD1 3.83Å
146	S	90.6	Very high	90.4	Very high	105 Å²	105	74.1 Å²	74.1	73%	0.734	40%	0.396	S	S	*	.	S	Bend	trans	-82.4	-20.6	175	47.8	0	0	0	0	112.9
147	E	89.7	Confident	90.4	Very high	108 Å²	108	71.6 Å²	71.6	51%	0.505	38%	0.384	S	S	.	.	S	Bend	trans	-100.4	-11.2	-173.9	-61.6	179.7	-125.4	0	0	112.8	C145 H165	C145-E147 PolarHBondContact SG-N 3.3Å; C145-E147 VanDerWaalsContact SG-N 3.44Å; E147-H165 HydrophobicContact CB-CB 4.49Å; E147-H165 WeakPolarHBondContact OE2-CB 3.4Å; E147-H165 IonicContact OE2-CG 3.15Å; E147-H165 IonicContact OE2-ND1 3.39Å
148	C	91.9	Very high	90.5	Very high	40 Å²	40	68.5 Å²	68.5	27%	0.27	37%	0.37	S	S	.	.	S	Bend	trans	-152.6	169.2	170.4	71.3	0	0	0	0	111.4	C145 K150 H161 H165	C145-C148 CarbonylContact C-O 3.25Å; C145-C148 WeakPolarHBondContact CB-O 3.14Å; C148-K150 PolarHBondContact O-N 2.93Å; C148-H161 PolarHBondContact SG-NE2 3.29Å; C148-H165 PolarHBondContact SG-NE2 3.09Å
149	E	88.4	Confident	90.6	Very high	206 Å²	206	65.8 Å²	65.8	96%	0.963	35%	0.353	S	S	*	.	S	Bend	trans	-72.4	2.5	-177.1	-61.2	178.6	172.7	0	0	114.3
150	K	90.4	Very high	90.6	Very high	126 Å²	126	67.9 Å²	67.9	55%	0.548	35%	0.35	S	S	.	.			trans	-75.3	133.7	-176.4	-68.2	-178.7	177.4	175.5	0	111.6	C145 C148 F152	C145-K150 WeakPolarHBondContact CB-O 3.27Å; C145-K150 PolarHBondContact N-O 3.03Å; C148-K150 PolarHBondContact O-N 2.93Å; K150-F152 HydrophobicContact CB-CE2 3.94Å; K150-F152 HydrophobicContact CB-CZ 4.03Å
151	A	92	Very high	90.7	Very high	24 Å²	24	64.5 Å²	64.5	20%	0.198	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	148.4	174.8	0	0	0	0	0	111.4	K141 Y143 R144	K141-A151 HydrophobicContact CB-CB 3.57Å; K141-A151 HydrophobicContact CD-CB 4.23Å; K141-A151 WeakPolarHBondContact CD-O 3.38Å; K141-A151 HydrophobicContact CG-CB 4.46Å; Y143-A151 CarbonylContact O-C 3.24Å; Y143-A151 WeakPolarHBondContact O-CA 3.49Å; R144-A151 HydrophobicContact CG-CB 3.93Å
152	F	90.9	Very high	90.7	Very high	42 Å²	42	61.4 Å²	61.4	18%	0.184	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.9	-174.5	-58.5	-90.1	0	0	0	110.7	K141 Y143 K150 D154 A157 L158 H161	K141-F152 CarbonylContact C-O 3.51Å; K141-F152 VanDerWaalsContact C-O 3.25Å; K141-F152 VanDerWaalsContact CA-O 3.3Å; K141-F152 WeakPolarHBondContact CA-O 3.42Å; Y143-F152 WeakPolarHBondContact CD2-O 2.87Å; Y143-F152 PolarHBondContact N-O 3.4Å; Y143-F152 VanDerWaalsContact N-O 3.13Å; Y143-F152 PolarHBondContact O-N 3.2Å; K150-F152 HydrophobicContact CB-CE2 3.94Å; K150-F152 HydrophobicContact CB-CZ 4.03Å; F152-D154 VanDerWaalsContact C-N 3.31Å; F152-A157 HydrophobicContact CB-CB 4.27Å; F152-A157 HydrophobicContact CD1-CB 3.94Å; F152-A157 HydrophobicContact CG-CB 4.37Å; F152-L158 HydrophobicContact CB-CB 4.25Å; F152-L158 HydrophobicContact CD2-CB 3.85Å; F152-L158 HydrophobicContact CD2-CD1 3.71Å; F152-L158 HydrophobicContact CD2-CG 4.38Å; F152-L158 HydrophobicContact CE2-CD1 3.91Å; F152-L158 HydrophobicContact CG-CB 4.2Å; F152-H161 HydrophobicContact CE1-CB 3.88Å; F152-H161 HydrophobicContact CE2-CB 3.82Å; F152-H161 AromaticContact CE2-CD2 3.3Å; F152-H161 WeakPolarHBondContact CE2-CD2 2.85Å; F152-H161 AromaticContact CE2-CG 3.54Å; F152-H161 AromaticContact CE2-NE2 3.99Å; F152-H161 HydrophobicContact CZ-CB 3.38Å; F152-H161 AromaticContact CZ-CD2 3.39Å; F152-H161 WeakPolarHBondContact CZ-CD2 3.48Å; F152-H161 AromaticContact CZ-CG 3.13Å; F152-H161 AromaticContact CZ-ND1 3.62Å; F152-H161 AromaticContact CZ-NE2 3.95Å
153	S	89.8	Confident	90.8	Very high	43 Å²	43	62.6 Å²	62.6	30%	0.301	32%	0.324	S	S	.	.	S	Bend	trans	-81.1	-12.9	176.4	54.6	0	0	0	0	113	R135	R135-S153 WeakPolarHBondContact CD-O 3.18Å; R135-S153 PolarHBondContact NH1-O 3.15Å
154	D	88.4	Confident	90.8	Very high	39 Å²	39	65.1 Å²	65.1	21%	0.209	34%	0.338	C	S	.	.	S	Bend	trans	-135.6	141.2	-178.8	-171.3	35	0	0	0	111.2	K132 Y143 F152 S156 A157 L158	K132-D154 WeakPolarHBondContact CE-OD1 3.26Å; K132-D154 IonicContact NZ-OD1 2.98Å; K132-D154 PolarHBondContact NZ-OD1 2.84Å; K132-D154 IonicContact NZ-OD2 2.78Å; K132-D154 PolarHBondContact NZ-OD2 2.95Å; Y143-D154 VanDerWaalsContact CD2-C 3.43Å; F152-D154 VanDerWaalsContact C-N 3.31Å; D154-S156 PolarHBondContact O-N 3.25Å; D154-A157 HydrophobicContact CB-CB 4.34Å; D154-A157 PolarHBondContact O-N 3.06Å; D154-L158 PolarHBondContact O-N 3.34Å
155	C	89.4	Confident	90.9	Very high	19 Å²	19	60 Å²	60	13%	0.128	32%	0.322	C	S	.	.	H	α-helix	trans	-62.9	-44.2	178.8	153.3	0	0	0	0	111	C38 Y143 A157 L158 V159	C38-C155 HydrophobicContact CB-CB 3.82Å; C38-C155 WeakPolarHBondContact CB-SG 3.19Å; C38-C155 WeakPolarHBondContact SG-CB 3.16Å; C38-C155 CovalentContact SG-SG 1.99Å; C38-C155 PolarHBondContact SG-SG 3.32Å; Y143-C155 HydrophobicContact CD1-CB 3.93Å; Y143-C155 HydrophobicContact CE1-CB 3.68Å; Y143-C155 HydrophobicContact CE2-CB 4.44Å; Y143-C155 HydrophobicContact CG-CB 4.4Å; C155-A157 PolarHBondContact O-N 2.94Å; C155-L158 WeakPolarHBondContact O-CA 3.38Å; C155-L158 WeakPolarHBondContact O-CB 3.46Å; C155-L158 PolarHBondContact O-N 3.18Å; C155-V159 PolarHBondContact O-N 2.95Å
156	S	88.4	Confident	90.8	Very high	65 Å²	65	63.8 Å²	63.8	46%	0.455	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-33.8	-176.8	-58.5	0	0	0	0	111.7	D154 V159 Q160	D154-S156 PolarHBondContact O-N 3.25Å; S156-V159 PolarHBondContact O-N 3.37Å; S156-Q160 WeakPolarHBondContact O-CB 3.45Å; S156-Q160 VanDerWaalsContact O-CG 3.27Å; S156-Q160 WeakPolarHBondContact O-CG 3.46Å; S156-Q160 PolarHBondContact O-N 3.11Å
157	A	90.9	Very high	90.8	Very high	35 Å²	35	60.7 Å²	60.7	29%	0.289	33%	0.329	S	S	.	.	H	α-helix	trans	-67.3	-40.2	173.3	0	0	0	0	0	112.4	F152 D154 C155 H161	F152-A157 HydrophobicContact CB-CB 4.27Å; F152-A157 HydrophobicContact CD1-CB 3.94Å; F152-A157 HydrophobicContact CG-CB 4.37Å; D154-A157 HydrophobicContact CB-CB 4.34Å; D154-A157 PolarHBondContact O-N 3.06Å; C155-A157 PolarHBondContact O-N 2.94Å; A157-H161 VanDerWaalsContact O-CB 3.26Å; A157-H161 WeakPolarHBondContact O-CB 3.25Å; A157-H161 PolarHBondContact O-N 3.35Å
158	L	93	Very high	91	Very high	7 Å²	7	60.2 Å²	60.2	4%	0.037	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-46.4	173.3	172.5	62.5	0	0	0	111.6	C145 F152 D154 C155 Q160 H161 Q162	C145-L158 HydrophobicContact CB-CD1 3.83Å; F152-L158 HydrophobicContact CB-CB 4.25Å; F152-L158 HydrophobicContact CD2-CB 3.85Å; F152-L158 HydrophobicContact CD2-CD1 3.71Å; F152-L158 HydrophobicContact CD2-CG 4.38Å; F152-L158 HydrophobicContact CE2-CD1 3.91Å; F152-L158 HydrophobicContact CG-CB 4.2Å; D154-L158 PolarHBondContact O-N 3.34Å; C155-L158 WeakPolarHBondContact O-CA 3.38Å; C155-L158 WeakPolarHBondContact O-CB 3.46Å; C155-L158 PolarHBondContact O-N 3.18Å; L158-Q160 PolarHBondContact O-N 3.44Å; L158-H161 CarbonylContact O-C 3.26Å; L158-H161 WeakPolarHBondContact O-CA 3.25Å; L158-H161 WeakPolarHBondContact O-CB 3.46Å; L158-H161 PolarHBondContact O-N 3.49Å; L158-H161 VanDerWaalsContact O-N 3.08Å; L158-Q162 HydrophobicContact CD1-CG 4.25Å; L158-Q162 WeakPolarHBondContact O-CG 3.28Å; L158-Q162 PolarHBondContact O-N 3.26Å
159	V	90.6	Very high	91.1	Very high	36 Å²	36	64 Å²	64	22%	0.218	34%	0.339	C	S	.	.	H	α-helix	trans	-61.9	-44.8	179.4	174.3	0	0	0	0	110.9	T40 C155 S156 H161 Q162	T40-V159 HydrophobicContact CG2-CB 4.36Å; T40-V159 HydrophobicContact CG2-CG1 3.93Å; T40-V159 HydrophobicContact CG2-CG2 3.45Å; T40-V159 VanDerWaalsContact CG2-CG2 3.45Å; C155-V159 PolarHBondContact O-N 2.95Å; S156-V159 PolarHBondContact O-N 3.37Å; V159-H161 VanDerWaalsContact C-N 3.26Å; V159-H161 PolarHBondContact O-N 3.12Å; V159-Q162 PolarHBondContact O-N 3.41Å
160	Q	90.8	Very high	91.3	Very high	90 Å²	90	56.9 Å²	56.9	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-62.2	-35.8	174.2	-74.1	178.7	12.8	0	0	112.3	S156 L158 R163	S156-Q160 WeakPolarHBondContact O-CB 3.45Å; S156-Q160 VanDerWaalsContact O-CG 3.27Å; S156-Q160 WeakPolarHBondContact O-CG 3.46Å; S156-Q160 PolarHBondContact O-N 3.11Å; L158-Q160 PolarHBondContact O-N 3.44Å; Q160-R163 WeakPolarHBondContact O-CB 3.35Å
161	H	92.1	Very high	91.6	Very high	16 Å²	16	54.5 Å²	54.5	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-69.1	-37.9	176	169.6	68.6	0	0	0	112.7	C148 F152 A157 L158 V159 R163 I164 H165	C148-H161 PolarHBondContact SG-NE2 3.29Å; F152-H161 HydrophobicContact CE1-CB 3.88Å; F152-H161 HydrophobicContact CE2-CB 3.82Å; F152-H161 AromaticContact CE2-CD2 3.3Å; F152-H161 WeakPolarHBondContact CE2-CD2 2.85Å; F152-H161 AromaticContact CE2-CG 3.54Å; F152-H161 AromaticContact CE2-NE2 3.99Å; F152-H161 HydrophobicContact CZ-CB 3.38Å; F152-H161 AromaticContact CZ-CD2 3.39Å; F152-H161 WeakPolarHBondContact CZ-CD2 3.48Å; F152-H161 AromaticContact CZ-CG 3.13Å; F152-H161 AromaticContact CZ-ND1 3.62Å; F152-H161 AromaticContact CZ-NE2 3.95Å; A157-H161 VanDerWaalsContact O-CB 3.26Å; A157-H161 WeakPolarHBondContact O-CB 3.25Å; A157-H161 PolarHBondContact O-N 3.35Å; L158-H161 CarbonylContact O-C 3.26Å; L158-H161 WeakPolarHBondContact O-CA 3.25Å; L158-H161 WeakPolarHBondContact O-CB 3.46Å; L158-H161 PolarHBondContact O-N 3.49Å; L158-H161 VanDerWaalsContact O-N 3.08Å; V159-H161 VanDerWaalsContact C-N 3.26Å; V159-H161 PolarHBondContact O-N 3.12Å; H161-R163 PolarHBondContact O-N 3.25Å; H161-R163 VanDerWaalsContact O-N 3.14Å; H161-I164 WeakPolarHBondContact ND1-CD1 3.45Å; H161-I164 WeakPolarHBondContact O-CA 3.31Å; H161-I164 WeakPolarHBondContact O-CB 3.23Å; H161-I164 WeakPolarHBondContact O-CG1 3.3Å; H161-I164 PolarHBondContact O-N 2.96Å; H161-H165 AromaticContact CE1-NE2 3.83Å; H161-H165 AromaticContact NE2-NE2 3.43Å; H161-H165 PolarHBondContact NE2-NE2 3.13Å
162	Q	91.6	Very high	91.8	Very high	55 Å²	55	59.5 Å²	59.5	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-58.4	-29.2	178.2	-77.2	173.4	-45.9	0	0	112.6	L158 V159 I164 H165 T166	L158-Q162 HydrophobicContact CD1-CG 4.25Å; L158-Q162 WeakPolarHBondContact O-CG 3.28Å; L158-Q162 PolarHBondContact O-N 3.26Å; V159-Q162 PolarHBondContact O-N 3.41Å; Q162-I164 PolarHBondContact O-N 3.11Å; Q162-H165 PolarHBondContact O-N 3.05Å; Q162-T166 PolarHBondContact O-N 2.96Å; Q162-T166 VanDerWaalsContact O-N 3.13Å
163	R	93	Very high	92	Very high	41 Å²	41	57.5 Å²	57.5	16%	0.155	31%	0.31	C	S	.	.	H	α-helix	trans	-56.5	-22.2	171.8	-59.6	-177.9	177.1	165.2	1.3	113.5	Q160 H161 H165 T166 G167 E168 R181	Q160-R163 WeakPolarHBondContact O-CB 3.35Å; H161-R163 PolarHBondContact O-N 3.25Å; H161-R163 VanDerWaalsContact O-N 3.14Å; R163-H165 VanDerWaalsContact C-N 3.32Å; R163-T166 WeakPolarHBondContact CA-OG1 3.39Å; R163-G167 PolarHBondContact O-N 3.12Å; R163-G167 VanDerWaalsContact O-N 3.09Å; R163-E168 HydrophobicContact CB-CB 4.46Å; R163-E168 HydrophobicContact CG-CB 4.34Å; R163-E168 IonicContact NE-OE2 3.96Å; R163-R181 HydrophobicContact CB-CG 3.56Å; R163-R181 HydrophobicContact CG-CG 4.32Å; R163-R181 PolarHBondContact NH1-O 2.96Å; R163-R181 PolarHBondContact O-NE 3.02Å; R163-R181 PolarHBondContact O-NH2 3.3Å
164	I	91.9	Very high	92.2	Very high	84 Å²	84	60.4 Å²	60.4	43%	0.431	33%	0.33	S	S	.	.	H	α-helix	trans	-59	-46	172.1	-58.3	-174.2	0	0	0	111	H161 Q162 R181	H161-I164 WeakPolarHBondContact ND1-CD1 3.45Å; H161-I164 WeakPolarHBondContact O-CA 3.31Å; H161-I164 WeakPolarHBondContact O-CB 3.23Å; H161-I164 WeakPolarHBondContact O-CG1 3.3Å; H161-I164 PolarHBondContact O-N 2.96Å; Q162-I164 PolarHBondContact O-N 3.11Å; I164-R181 VanDerWaalsContact CA-NH2 3.3Å; I164-R181 PolarHBondContact O-NH2 2.99Å
165	H	92.2	Very high	92.5	Very high	69 Å²	69	63.5 Å²	63.5	32%	0.319	35%	0.346	S	S	.	.	H	α-helix	trans	-82.2	-41.2	-175.8	-57.5	-78.5	0	0	0	112.5	E147 C148 H161 Q162 R163 G167	E147-H165 HydrophobicContact CB-CB 4.49Å; E147-H165 WeakPolarHBondContact OE2-CB 3.4Å; E147-H165 IonicContact OE2-CG 3.15Å; E147-H165 IonicContact OE2-ND1 3.39Å; C148-H165 PolarHBondContact SG-NE2 3.09Å; H161-H165 AromaticContact CE1-NE2 3.83Å; H161-H165 AromaticContact NE2-NE2 3.43Å; H161-H165 PolarHBondContact NE2-NE2 3.13Å; Q162-H165 PolarHBondContact O-N 3.05Å; R163-H165 VanDerWaalsContact C-N 3.32Å; H165-G167 PolarHBondContact O-N 3.3Å
166	T	90.8	Very high	92.7	Very high	89 Å²	89	65.1 Å²	65.1	55%	0.546	36%	0.358	S	S	.	.	H	α-helix	trans	-72.8	-17.1	178.8	65.8	0	0	0	0	113.3	Q162 R163 E168	Q162-T166 PolarHBondContact O-N 2.96Å; Q162-T166 VanDerWaalsContact O-N 3.13Å; R163-T166 WeakPolarHBondContact CA-OG1 3.39Å; T166-E168 PolarHBondContact O-N 2.77Å; T166-E168 WeakPolarHBondContact OG1-CB 3.45Å; T166-E168 PolarHBondContact OG1-N 2.8Å
167	G	90.9	Very high	93	Very high	40 Å²	40	64 Å²	64	41%	0.412	36%	0.356	S	S	.	.			trans	72.5	2.4	-174.1	0	0	0	0	0	114.2	R163 H165 K169	R163-G167 PolarHBondContact O-N 3.12Å; R163-G167 VanDerWaalsContact O-N 3.09Å; H165-G167 PolarHBondContact O-N 3.3Å; G167-K169 PolarHBondContact O-N 3.24Å
168	E	92.5	Very high	93.2	Very high	99 Å²	99	68.5 Å²	68.5	46%	0.463	37%	0.369	S	S	.	.			trans	-57.4	129.9	-177.8	-167	-162.8	172.8	0	0	111.3	R163 T166 P170	R163-E168 HydrophobicContact CB-CB 4.46Å; R163-E168 HydrophobicContact CG-CB 4.34Å; R163-E168 IonicContact NE-OE2 3.96Å; T166-E168 PolarHBondContact O-N 2.77Å; T166-E168 WeakPolarHBondContact OG1-CB 3.45Å; T166-E168 PolarHBondContact OG1-N 2.8Å; E168-P170 HydrophobicContact CG-CG 3.9Å; E168-P170 WeakPolarHBondContact OE1-CG 3.5Å
169	K	94.1	Very high	93.3	Very high	118 Å²	118	69.7 Å²	69.7	51%	0.513	38%	0.38	S	S	.	.			trans	-131.5	78.6	179.4	-72.7	165.8	173.2	-174.2	0	109.8	G167 Y171 A179 F180	G167-K169 PolarHBondContact O-N 3.24Å; K169-Y171 PolarHBondContact O-N 3.35Å; K169-Y171 VanDerWaalsContact O-N 3.1Å; K169-A179 HydrophobicContact CB-CB 3.61Å; K169-A179 HydrophobicContact CD-CB 4.19Å; K169-A179 WeakPolarHBondContact CD-O 3.38Å; K169-F180 CarbonylContact C-O 3.5Å; K169-F180 VanDerWaalsContact C-O 3.23Å; K169-F180 VanDerWaalsContact CA-O 3.28Å; K169-F180 WeakPolarHBondContact CA-O 3.31Å
170	P	93.4	Very high	93.5	Very high	58 Å²	58	70 Å²	70	38%	0.377	38%	0.379	S	S	.	.			trans	-67.5	-12.9	-171.6	-22.6	35.3	0	0	0	115	E168	E168-P170 HydrophobicContact CG-CG 3.9Å; E168-P170 WeakPolarHBondContact OE1-CG 3.5Å
171	Y	95.9	Very high	93.6	Very high	76 Å²	76	68.6 Å²	68.6	30%	0.298	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	96.9	-170.4	-53.7	-76.2	0	0	0	110	K169 A179 F180 R181 S183	K169-Y171 PolarHBondContact O-N 3.35Å; K169-Y171 VanDerWaalsContact O-N 3.1Å; Y171-A179 CarbonylContact O-C 3.53Å; Y171-A179 WeakPolarHBondContact O-CA 3.42Å; Y171-F180 WeakPolarHBondContact CD2-O 3.35Å; Y171-F180 PolarHBondContact N-O 2.59Å; Y171-F180 VanDerWaalsContact N-O 3.14Å; Y171-F180 PolarHBondContact O-N 3.36Å; Y171-R181 WeakPolarHBondContact CE2-O 3.43Å; Y171-S183 VanDerWaalsContact CD2-N 3.27Å; Y171-S183 VanDerWaalsContact CE2-N 3.3Å
172	E	96.2	Very high	93.6	Very high	129 Å²	129	70.9 Å²	70.9	60%	0.603	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.9	-179.1	-167	174.7	163	0	0	112.5	A179 L186	E172-A179 HydrophobicContact CB-CB 4.4Å; E172-A179 HydrophobicContact CG-CB 4.39Å; E172-L186 WeakPolarHBondContact O-CD2 3.45Å
173	C	95.9	Very high	93.6	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.389	C	S	.	.			trans	-84.1	118.9	172.9	-178.8	0	0	0	0	110.4	D175 C176 G177 K178 F180 L186 H193	C173-D175 PolarHBondContact O-N 3.49Å; C173-C176 PolarHBondContact O-N 3.36Å; C173-G177 VanDerWaalsContact O-CA 3.29Å; C173-G177 WeakPolarHBondContact O-CA 3.35Å; C173-G177 PolarHBondContact O-N 3.12Å; C173-K178 WeakPolarHBondContact CB-O 3.35Å; C173-K178 PolarHBondContact N-O 3.17Å; C173-F180 HydrophobicContact CB-CE2 4.43Å; C173-L186 HydrophobicContact CB-CD1 3.56Å; C173-H193 PolarHBondContact SG-NE2 3.34Å; C173-H193 VanDerWaalsContact SG-NE2 3.36Å
174	S	94.8	Very high	93.5	Very high	103 Å²	103	71.9 Å²	71.9	72%	0.72	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.9	176	50.1	0	0	0	0	113.7
175	D	93.4	Very high	93.6	Very high	104 Å²	104	71.4 Å²	71.4	56%	0.556	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-22.8	-168.7	-49.1	-26.3	0	0	0	112.8	C173 H193	C173-D175 PolarHBondContact O-N 3.49Å; D175-H193 IonicContact OD2-CD2 2.95Å; D175-H193 PolarHBondContact OD2-CD2 3.12Å; D175-H193 IonicContact OD2-CG 3.06Å
176	C	95.2	Very high	93.7	Very high	54 Å²	54	69.1 Å²	69.1	37%	0.365	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.7	4.2	-174.9	74.3	0	0	0	0	115	C173 K178 H189 H193	C173-C176 PolarHBondContact O-N 3.36Å; C176-K178 PolarHBondContact O-N 2.92Å; C176-K178 VanDerWaalsContact O-N 3.1Å; C176-K178 VanDerWaalsContact SG-CB 3.59Å; C176-H189 PolarHBondContact SG-NE2 3.05Å; C176-H193 PolarHBondContact SG-NE2 3.37Å; C176-H193 VanDerWaalsContact SG-NE2 3.43Å
177	G	93.5	Very high	93.8	Very high	42 Å²	42	68.2 Å²	68.2	43%	0.433	39%	0.386	S	S	.	.			trans	67.4	4.6	-179.3	0	0	0	0	0	114.9	C173 A179	C173-G177 VanDerWaalsContact O-CA 3.29Å; C173-G177 WeakPolarHBondContact O-CA 3.35Å; C173-G177 PolarHBondContact O-N 3.12Å; G177-A179 PolarHBondContact O-N 3.47Å
178	K	95.4	Very high	93.8	Very high	128 Å²	128	68.4 Å²	68.4	56%	0.557	38%	0.377	S	S	*	.			trans	-72	124.1	179.5	-74.2	-178.6	-178.6	174.5	0	110.4	C173 C176 F180	C173-K178 WeakPolarHBondContact CB-O 3.35Å; C173-K178 PolarHBondContact N-O 3.17Å; C176-K178 PolarHBondContact O-N 2.92Å; C176-K178 VanDerWaalsContact O-N 3.1Å; C176-K178 VanDerWaalsContact SG-CB 3.59Å; K178-F180 HydrophobicContact CB-CE2 4.01Å; K178-F180 HydrophobicContact CB-CZ 4.13Å; K178-F180 WeakPolarHBondContact O-CD2 3.34Å; K178-F180 VanDerWaalsContact O-CE2 3.24Å; K178-F180 WeakPolarHBondContact O-CE2 3.47Å
179	A	95.4	Very high	93.8	Very high	32 Å²	32	64.7 Å²	64.7	26%	0.264	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	144.4	178.7	0	0	0	0	0	113.5	K169 Y171 E172 G177	K169-A179 HydrophobicContact CB-CB 3.61Å; K169-A179 HydrophobicContact CD-CB 4.19Å; K169-A179 WeakPolarHBondContact CD-O 3.38Å; Y171-A179 CarbonylContact O-C 3.53Å; Y171-A179 WeakPolarHBondContact O-CA 3.42Å; E172-A179 HydrophobicContact CB-CB 4.4Å; E172-A179 HydrophobicContact CG-CB 4.39Å; G177-A179 PolarHBondContact O-N 3.47Å
180	F	94.3	Very high	93.8	Very high	44 Å²	44	62.2 Å²	62.2	19%	0.193	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	150.9	-176.2	-58.8	-89.1	0	0	0	111.7	K169 Y171 C173 K178 N185 L186 H189	K169-F180 CarbonylContact C-O 3.5Å; K169-F180 VanDerWaalsContact C-O 3.23Å; K169-F180 VanDerWaalsContact CA-O 3.28Å; K169-F180 WeakPolarHBondContact CA-O 3.31Å; Y171-F180 WeakPolarHBondContact CD2-O 3.35Å; Y171-F180 PolarHBondContact N-O 2.59Å; Y171-F180 VanDerWaalsContact N-O 3.14Å; Y171-F180 PolarHBondContact O-N 3.36Å; C173-F180 HydrophobicContact CB-CE2 4.43Å; K178-F180 HydrophobicContact CB-CE2 4.01Å; K178-F180 HydrophobicContact CB-CZ 4.13Å; K178-F180 WeakPolarHBondContact O-CD2 3.34Å; K178-F180 VanDerWaalsContact O-CE2 3.24Å; K178-F180 WeakPolarHBondContact O-CE2 3.47Å; F180-N185 HydrophobicContact CB-CB 4.14Å; F180-N185 HydrophobicContact CD1-CB 3.88Å; F180-N185 HydrophobicContact CG-CB 4.23Å; F180-L186 HydrophobicContact CB-CB 4.35Å; F180-L186 HydrophobicContact CD2-CB 3.84Å; F180-L186 HydrophobicContact CD2-CD1 3.83Å; F180-L186 HydrophobicContact CD2-CG 4.45Å; F180-L186 HydrophobicContact CE2-CD1 3.98Å; F180-L186 HydrophobicContact CG-CB 4.29Å; F180-H189 HydrophobicContact CE1-CB 3.94Å; F180-H189 HydrophobicContact CE2-CB 3.74Å; F180-H189 AromaticContact CE2-CD2 3.35Å; F180-H189 WeakPolarHBondContact CE2-CD2 3.47Å; F180-H189 AromaticContact CE2-CG 3.63Å; F180-H189 HydrophobicContact CZ-CB 3.33Å; F180-H189 AromaticContact CZ-CD2 3.38Å; F180-H189 WeakPolarHBondContact CZ-CD2 3.5Å; F180-H189 AromaticContact CZ-CG 3.21Å; F180-H189 AromaticContact CZ-ND1 3.91Å
181	R	92.8	Very high	93.8	Very high	60 Å²	60	61.3 Å²	61.3	23%	0.226	34%	0.339	C	S	.	.	S	Bend	trans	-76.8	-24.2	178.3	-176.5	171.6	-70.2	139.4	0.6	114	R163 I164 Y171	R163-R181 HydrophobicContact CB-CG 3.56Å; R163-R181 HydrophobicContact CG-CG 4.32Å; R163-R181 PolarHBondContact NH1-O 2.96Å; R163-R181 PolarHBondContact O-NE 3.02Å; R163-R181 PolarHBondContact O-NH2 3.3Å; I164-R181 VanDerWaalsContact CA-NH2 3.3Å; I164-R181 PolarHBondContact O-NH2 2.99Å; Y171-R181 WeakPolarHBondContact CE2-O 3.43Å
182	H	91.8	Very high	93.6	Very high	64 Å²	64	61.5 Å²	61.5	30%	0.296	35%	0.348	S	S	.	.	S	Bend	trans	-131.1	139.4	-177.1	-56.3	-84.3	0	0	0	110.1	A184 N185 L186	H182-A184 VanDerWaalsContact C-N 3.32Å; H182-A184 PolarHBondContact O-N 3.49Å; H182-N185 WeakPolarHBondContact O-CB 3.39Å; H182-N185 PolarHBondContact O-N 2.87Å; H182-N185 VanDerWaalsContact O-N 3.1Å; H182-L186 PolarHBondContact O-N 3.37Å
183	S	93.1	Very high	93.5	Very high	62 Å²	62	59.1 Å²	59.1	43%	0.434	34%	0.337	S	S	.	.	H	α-helix	trans	-59.7	-41.2	179.3	54.3	0	0	0	0	112.4	Y171 N185 L186 T187	Y171-S183 VanDerWaalsContact CD2-N 3.27Å; Y171-S183 VanDerWaalsContact CE2-N 3.3Å; S183-N185 PolarHBondContact O-N 3.09Å; S183-L186 WeakPolarHBondContact O-CA 3.38Å; S183-L186 WeakPolarHBondContact O-CB 3.36Å; S183-L186 PolarHBondContact O-N 3.34Å; S183-T187 PolarHBondContact O-N 3.16Å; S183-T187 PolarHBondContact O-OG1 2.79Å
184	A	90.4	Very high	93.3	Very high	54 Å²	54	63.8 Å²	63.8	45%	0.446	37%	0.365	S	S	.	.	H	α-helix	trans	-58.3	-32.8	177.4	0	0	0	0	0	112.7	H182 N188	H182-A184 VanDerWaalsContact C-N 3.32Å; H182-A184 PolarHBondContact O-N 3.49Å; A184-N188 WeakPolarHBondContact O-CB 3.35Å; A184-N188 VanDerWaalsContact O-CG 3.23Å; A184-N188 PolarHBondContact O-N 3.5Å; A184-N188 PolarHBondContact O-ND2 3.04Å; A184-N188 VanDerWaalsContact O-ND2 3.12Å
185	N	93.3	Very high	93.1	Very high	75 Å²	75	61 Å²	61	40%	0.401	35%	0.353	S	S	.	.	H	α-helix	trans	-72.4	-38.2	176.5	-67.1	-8.6	0	0	0	111.3	F180 H182 S183 N188 H189	F180-N185 HydrophobicContact CB-CB 4.14Å; F180-N185 HydrophobicContact CD1-CB 3.88Å; F180-N185 HydrophobicContact CG-CB 4.23Å; H182-N185 WeakPolarHBondContact O-CB 3.39Å; H182-N185 PolarHBondContact O-N 2.87Å; H182-N185 VanDerWaalsContact O-N 3.1Å; S183-N185 PolarHBondContact O-N 3.09Å; N185-N188 PolarHBondContact O-N 3.49Å; N185-H189 VanDerWaalsContact O-CB 3.29Å; N185-H189 WeakPolarHBondContact O-CB 3.28Å; N185-H189 PolarHBondContact O-N 3.11Å
186	L	94.7	Very high	93.1	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.11	35%	0.349	C	S	.	.	H	α-helix	trans	-62.1	-49.4	172	171.6	62.3	0	0	0	110.9	E172 C173 F180 H182 S183 N188 H189 Q190	E172-L186 WeakPolarHBondContact O-CD2 3.45Å; C173-L186 HydrophobicContact CB-CD1 3.56Å; F180-L186 HydrophobicContact CB-CB 4.35Å; F180-L186 HydrophobicContact CD2-CB 3.84Å; F180-L186 HydrophobicContact CD2-CD1 3.83Å; F180-L186 HydrophobicContact CD2-CG 4.45Å; F180-L186 HydrophobicContact CE2-CD1 3.98Å; F180-L186 HydrophobicContact CG-CB 4.29Å; H182-L186 PolarHBondContact O-N 3.37Å; S183-L186 WeakPolarHBondContact O-CA 3.38Å; S183-L186 WeakPolarHBondContact O-CB 3.36Å; S183-L186 PolarHBondContact O-N 3.34Å; L186-N188 VanDerWaalsContact C-N 3.3Å; L186-N188 PolarHBondContact O-N 3.15Å; L186-H189 CarbonylContact O-C 3.52Å; L186-H189 WeakPolarHBondContact O-CA 3.41Å; L186-H189 WeakPolarHBondContact O-CB 3.43Å; L186-H189 PolarHBondContact O-N 3.42Å; L186-Q190 HydrophobicContact CD1-CG 4.14Å; L186-Q190 WeakPolarHBondContact O-CG 3.36Å; L186-Q190 PolarHBondContact O-N 3.48Å
187	T	92.3	Very high	93	Very high	70 Å²	70	63.9 Å²	63.9	43%	0.429	36%	0.356	S	S	.	.	H	α-helix	trans	-57.5	-44.4	177.8	-55.9	0	0	0	0	111.7	S183 H189 Q190	S183-T187 PolarHBondContact O-N 3.16Å; S183-T187 PolarHBondContact O-OG1 2.79Å; T187-H189 VanDerWaalsContact C-N 3.33Å; T187-H189 PolarHBondContact O-N 2.99Å; T187-Q190 PolarHBondContact O-N 3.26Å
188	N	91.2	Very high	93	Very high	44 Å²	44	64.9 Å²	64.9	24%	0.235	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-36.5	175.9	-75.8	-30.7	0	0	0	112.5	A184 N185 L186 R191 Y210	A184-N188 WeakPolarHBondContact O-CB 3.35Å; A184-N188 VanDerWaalsContact O-CG 3.23Å; A184-N188 PolarHBondContact O-N 3.5Å; A184-N188 PolarHBondContact O-ND2 3.04Å; A184-N188 VanDerWaalsContact O-ND2 3.12Å; N185-N188 PolarHBondContact O-N 3.49Å; L186-N188 VanDerWaalsContact C-N 3.3Å; L186-N188 PolarHBondContact O-N 3.15Å; N188-R191 WeakPolarHBondContact O-CB 3.47Å; N188-R191 PolarHBondContact O-N 3.06Å; N188-R191 PolarHBondContact OD1-NH1 3.15Å; N188-Y210 HydrophobicContact CB-CE1 3.81Å
189	H	93.6	Very high	93	Very high	21 Å²	21	62.5 Å²	62.5	10%	0.097	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-41.1	175.1	171.9	56.4	0	0	0	112.1	C176 F180 N185 L186 T187 R191 T192 H193	C176-H189 PolarHBondContact SG-NE2 3.05Å; F180-H189 HydrophobicContact CE1-CB 3.94Å; F180-H189 HydrophobicContact CE2-CB 3.74Å; F180-H189 AromaticContact CE2-CD2 3.35Å; F180-H189 WeakPolarHBondContact CE2-CD2 3.47Å; F180-H189 AromaticContact CE2-CG 3.63Å; F180-H189 HydrophobicContact CZ-CB 3.33Å; F180-H189 AromaticContact CZ-CD2 3.38Å; F180-H189 WeakPolarHBondContact CZ-CD2 3.5Å; F180-H189 AromaticContact CZ-CG 3.21Å; F180-H189 AromaticContact CZ-ND1 3.91Å; N185-H189 VanDerWaalsContact O-CB 3.29Å; N185-H189 WeakPolarHBondContact O-CB 3.28Å; N185-H189 PolarHBondContact O-N 3.11Å; L186-H189 CarbonylContact O-C 3.52Å; L186-H189 WeakPolarHBondContact O-CA 3.41Å; L186-H189 WeakPolarHBondContact O-CB 3.43Å; L186-H189 PolarHBondContact O-N 3.42Å; T187-H189 VanDerWaalsContact C-N 3.33Å; T187-H189 PolarHBondContact O-N 2.99Å; H189-R191 PolarHBondContact O-N 3.4Å; H189-R191 VanDerWaalsContact O-N 3.08Å; H189-T192 PolarHBondContact CE1-OG1 3.24Å; H189-T192 PolarHBondContact ND1-OG1 3.17Å; H189-T192 WeakPolarHBondContact O-CB 3.38Å; H189-T192 PolarHBondContact O-N 3.49Å; H189-T192 PolarHBondContact O-OG1 3.27Å; H189-H193 AromaticContact CE1-NE2 3.72Å; H189-H193 AromaticContact NE2-CE1 3.94Å; H189-H193 AromaticContact NE2-NE2 3.25Å; H189-H193 PolarHBondContact NE2-NE2 3.48Å
190	Q	93.4	Very high	93	Very high	66 Å²	66	68 Å²	68	31%	0.308	36%	0.361	S	S	.	.	H	α-helix	trans	-56.3	-29.3	178.1	-75	170.2	-35.6	0	0	112.4	L186 T187 T192 H193 T194	L186-Q190 HydrophobicContact CD1-CG 4.14Å; L186-Q190 WeakPolarHBondContact O-CG 3.36Å; L186-Q190 PolarHBondContact O-N 3.48Å; T187-Q190 PolarHBondContact O-N 3.26Å; Q190-T192 PolarHBondContact O-N 3.46Å; Q190-T192 VanDerWaalsContact O-N 3.14Å; Q190-H193 PolarHBondContact O-N 3.46Å; Q190-T194 PolarHBondContact O-N 2.79Å; Q190-T194 VanDerWaalsContact O-N 3.14Å; Q190-T194 PolarHBondContact O-OG1 3.24Å
191	R	93.3	Very high	93.1	Very high	38 Å²	38	66 Å²	66	14%	0.143	35%	0.352	C	S	.	.	H	α-helix	trans	-60.2	-21.6	172.5	-59.8	-170.7	179.4	132.4	11.3	114.2	N188 H189 H193 T194 G195 E196 S209	N188-R191 WeakPolarHBondContact O-CB 3.47Å; N188-R191 PolarHBondContact O-N 3.06Å; N188-R191 PolarHBondContact OD1-NH1 3.15Å; H189-R191 PolarHBondContact O-N 3.4Å; H189-R191 VanDerWaalsContact O-N 3.08Å; R191-H193 VanDerWaalsContact C-N 3.31Å; R191-T194 WeakPolarHBondContact CA-OG1 3.47Å; R191-G195 WeakPolarHBondContact O-CA 3.44Å; R191-G195 PolarHBondContact O-N 3.35Å; R191-E196 HydrophobicContact CB-CB 4.41Å; R191-E196 HydrophobicContact CG-CB 4.28Å; R191-E196 IonicContact NE-OE2 3.96Å; R191-E196 PolarHBondContact O-N 2.77Å; R191-S209 PolarHBondContact NH1-O 3.3Å
192	T	92.1	Very high	93.2	Very high	80 Å²	80	68.5 Å²	68.5	49%	0.491	38%	0.379	S	S	.	.	H	α-helix	trans	-74.2	-24.5	175.2	69	0	0	0	0	112.6	H189 Q190	H189-T192 PolarHBondContact CE1-OG1 3.24Å; H189-T192 PolarHBondContact ND1-OG1 3.17Å; H189-T192 WeakPolarHBondContact O-CB 3.38Å; H189-T192 PolarHBondContact O-N 3.49Å; H189-T192 PolarHBondContact O-OG1 3.27Å; Q190-T192 PolarHBondContact O-N 3.46Å; Q190-T192 VanDerWaalsContact O-N 3.14Å
193	H	92.8	Very high	93.3	Very high	80 Å²	80	71 Å²	71	37%	0.37	39%	0.391	S	S	.	.	H	α-helix	trans	-86.5	-44.9	176.4	-59.3	-48.6	0	0	0	111.2	C173 D175 C176 H189 Q190 R191 G195	C173-H193 PolarHBondContact SG-NE2 3.34Å; C173-H193 VanDerWaalsContact SG-NE2 3.36Å; D175-H193 IonicContact OD2-CD2 2.95Å; D175-H193 PolarHBondContact OD2-CD2 3.12Å; D175-H193 IonicContact OD2-CG 3.06Å; C176-H193 PolarHBondContact SG-NE2 3.37Å; C176-H193 VanDerWaalsContact SG-NE2 3.43Å; H189-H193 AromaticContact CE1-NE2 3.72Å; H189-H193 AromaticContact NE2-CE1 3.94Å; H189-H193 AromaticContact NE2-NE2 3.25Å; H189-H193 PolarHBondContact NE2-NE2 3.48Å; Q190-H193 PolarHBondContact O-N 3.46Å; R191-H193 VanDerWaalsContact C-N 3.31Å; H193-G195 VanDerWaalsContact C-N 3.28Å; H193-G195 PolarHBondContact O-N 2.96Å
194	T	91.9	Very high	93.4	Very high	97 Å²	97	70.7 Å²	70.7	60%	0.595	39%	0.388	S	S	*	.	H	α-helix	trans	-76	-17.9	180	63.6	0	0	0	0	113.2	Q190 R191 E196	Q190-T194 PolarHBondContact O-N 2.79Å; Q190-T194 VanDerWaalsContact O-N 3.14Å; Q190-T194 PolarHBondContact O-OG1 3.24Å; R191-T194 WeakPolarHBondContact CA-OG1 3.47Å; T194-E196 PolarHBondContact O-N 3.31Å; T194-E196 WeakPolarHBondContact OG1-CB 3.49Å; T194-E196 PolarHBondContact OG1-N 2.83Å
195	G	91.4	Very high	93.5	Very high	44 Å²	44	70 Å²	70	45%	0.454	39%	0.386	S	S	.	.			trans	70.7	9.6	-172.8	0	0	0	0	0	113.8	R191 H193 K197	R191-G195 WeakPolarHBondContact O-CA 3.44Å; R191-G195 PolarHBondContact O-N 3.35Å; H193-G195 VanDerWaalsContact C-N 3.28Å; H193-G195 PolarHBondContact O-N 2.96Å; G195-K197 PolarHBondContact O-N 3.3Å
196	E	93.2	Very high	93.6	Very high	102 Å²	102	72.6 Å²	72.6	48%	0.477	39%	0.394	S	S	.	.			trans	-59.5	127.1	-178.8	-167.4	-163.3	174.7	0	0	110.8	R191 T194 P198 S209	R191-E196 HydrophobicContact CB-CB 4.41Å; R191-E196 HydrophobicContact CG-CB 4.28Å; R191-E196 IonicContact NE-OE2 3.96Å; R191-E196 PolarHBondContact O-N 2.77Å; T194-E196 PolarHBondContact O-N 3.31Å; T194-E196 WeakPolarHBondContact OG1-CB 3.49Å; T194-E196 PolarHBondContact OG1-N 2.83Å; E196-P198 HydrophobicContact CG-CG 4.02Å; E196-S209 WeakPolarHBondContact O-CB 3.33Å; E196-S209 PolarHBondContact O-OG 3.44Å
197	K	93.8	Very high	93.6	Very high	118 Å²	118	73.1 Å²	73.1	51%	0.513	40%	0.401	S	S	.	.			trans	-131	78.5	-179.6	-73.2	167	175.5	-177.3	0	109.9	G195 Y199 A207 F208 S209	G195-K197 PolarHBondContact O-N 3.3Å; K197-Y199 PolarHBondContact O-N 3.5Å; K197-Y199 VanDerWaalsContact O-N 3.15Å; K197-A207 HydrophobicContact CB-CB 3.56Å; K197-A207 HydrophobicContact CD-CB 4.2Å; K197-A207 WeakPolarHBondContact CD-O 3.48Å; K197-A207 HydrophobicContact CG-CB 4.45Å; K197-F208 CarbonylContact C-O 3.56Å; K197-F208 VanDerWaalsContact C-O 3.31Å; K197-F208 WeakPolarHBondContact CA-O 3.34Å; K197-S209 WeakPolarHBondContact CG-OG 3.31Å
198	P	92.9	Very high	93.6	Very high	63 Å²	63	71.9 Å²	71.9	41%	0.409	39%	0.39	S	S	.	.			trans	-63.7	-23.5	-172.9	-23.1	34.6	0	0	0	113.8	E196 K200	E196-P198 HydrophobicContact CG-CG 4.02Å; P198-K200 PolarHBondContact O-N 3.22Å
199	Y	95.1	Very high	93.7	Very high	77 Å²	77	70.8 Å²	70.8	30%	0.302	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	94.5	-172.3	-53.7	-82.1	0	0	0	110.2	K197 A207 F208 Y210 C211 F214	K197-Y199 PolarHBondContact O-N 3.5Å; K197-Y199 VanDerWaalsContact O-N 3.15Å; Y199-A207 CarbonylContact O-C 3.5Å; Y199-A207 VanDerWaalsContact O-CA 3.31Å; Y199-A207 WeakPolarHBondContact O-CA 3.46Å; Y199-F208 WeakPolarHBondContact CD2-O 3.41Å; Y199-F208 PolarHBondContact N-O 3.36Å; Y199-F208 VanDerWaalsContact N-O 3.16Å; Y199-F208 PolarHBondContact O-N 3.46Å; Y199-Y210 VanDerWaalsContact CD2-C 3.46Å; Y199-C211 HydrophobicContact CD1-CB 4.02Å; Y199-C211 HydrophobicContact CE1-CB 3.52Å; Y199-C211 HydrophobicContact CE2-CB 4.1Å; Y199-C211 VanDerWaalsContact CE2-N 3.29Å; Y199-C211 HydrophobicContact CG-CB 4.49Å; Y199-F214 HydrophobicContact CG-CB 4.36Å
200	K	95.7	Very high	93.5	Very high	148 Å²	148	74.6 Å²	74.6	64%	0.643	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	131.7	-179.5	-171.1	175.7	-179.5	-177.3	0	111.6	P198 A207	P198-K200 PolarHBondContact O-N 3.22Å; K200-A207 HydrophobicContact CB-CB 4.34Å; K200-A207 HydrophobicContact CG-CB 4.4Å
201	C	95.9	Very high	93.4	Very high	2 Å²	2	74 Å²	74	1%	0.014	40%	0.402	C	S	.	.			trans	-77.7	122	169.8	-177	0	0	0	0	110.2	E203 G205 K206 F214 H221	C201-E203 VanDerWaalsContact C-N 3.32Å; C201-G205 WeakPolarHBondContact O-CA 3.23Å; C201-G205 PolarHBondContact O-N 3.11Å; C201-K206 VanDerWaalsContact CB-O 3.27Å; C201-K206 WeakPolarHBondContact CB-O 3.45Å; C201-K206 PolarHBondContact N-O 2.96Å; C201-F214 HydrophobicContact CB-CD2 4.49Å; C201-F214 HydrophobicContact CB-CE2 3.88Å; C201-H221 PolarHBondContact SG-NE2 3.46Å
202	S	94.5	Very high	93.3	Very high	112 Å²	112	75.9 Å²	75.9	78%	0.783	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-33.1	175.6	45.7	0	0	0	0	112.5
203	E	94	Very high	93.4	Very high	117 Å²	117	73.5 Å²	73.5	55%	0.547	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-35.1	-172.9	-61.4	177.8	-133.4	0	0	113.9	C201 H221	C201-E203 VanDerWaalsContact C-N 3.32Å; E203-H221 IonicContact OE1-CD2 3.47Å; E203-H221 WeakPolarHBondContact OE2-CB 3.45Å; E203-H221 IonicContact OE2-CD2 3.47Å; E203-H221 PolarHBondContact OE2-CD2 3.38Å; E203-H221 IonicContact OE2-CG 3.16Å; E203-H221 IonicContact OE2-ND1 3.77Å
204	C	95	Very high	93.5	Very high	55 Å²	55	71.3 Å²	71.3	37%	0.372	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	4	-178.6	77	0	0	0	0	114.4	K206 H217	C204-K206 PolarHBondContact O-N 2.87Å; C204-K206 VanDerWaalsContact SG-CB 3.59Å; C204-K206 VanDerWaalsContact SG-CG 3.59Å; C204-H217 PolarHBondContact SG-NE2 2.76Å
205	G	93.3	Very high	93.6	Very high	40 Å²	40	70.5 Å²	70.5	41%	0.412	40%	0.396	S	S	.	.			trans	71.3	-8.3	-179.9	0	0	0	0	0	115.7	C201 A207	C201-G205 WeakPolarHBondContact O-CA 3.23Å; C201-G205 PolarHBondContact O-N 3.11Å; G205-A207 PolarHBondContact O-N 3.2Å
206	K	94.7	Very high	93.8	Very high	129 Å²	129	72.2 Å²	72.2	56%	0.561	39%	0.392	S	S	*	.			trans	-64.1	134.6	-179.4	-71.9	-178.3	179.7	177.6	0	111.2	C201 C204 F208	C201-K206 VanDerWaalsContact CB-O 3.27Å; C201-K206 WeakPolarHBondContact CB-O 3.45Å; C201-K206 PolarHBondContact N-O 2.96Å; C204-K206 PolarHBondContact O-N 2.87Å; C204-K206 VanDerWaalsContact SG-CB 3.59Å; C204-K206 VanDerWaalsContact SG-CG 3.59Å; K206-F208 HydrophobicContact CB-CE2 4.02Å; K206-F208 HydrophobicContact CB-CZ 4.13Å
207	A	94.8	Very high	93.9	Very high	33 Å²	33	68.2 Å²	68.2	27%	0.273	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.9	179.4	0	0	0	0	0	112	K197 Y199 K200 G205	K197-A207 HydrophobicContact CB-CB 3.56Å; K197-A207 HydrophobicContact CD-CB 4.2Å; K197-A207 WeakPolarHBondContact CD-O 3.48Å; K197-A207 HydrophobicContact CG-CB 4.45Å; Y199-A207 CarbonylContact O-C 3.5Å; Y199-A207 VanDerWaalsContact O-CA 3.31Å; Y199-A207 WeakPolarHBondContact O-CA 3.46Å; K200-A207 HydrophobicContact CB-CB 4.34Å; K200-A207 HydrophobicContact CG-CB 4.4Å; G205-A207 PolarHBondContact O-N 3.2Å
208	F	93.6	Very high	93.9	Very high	44 Å²	44	65.7 Å²	65.7	19%	0.193	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	145.4	-175.4	-57	-93.2	0	0	0	110.6	K197 Y199 K206 Y210 A213 F214 H217	K197-F208 CarbonylContact C-O 3.56Å; K197-F208 VanDerWaalsContact C-O 3.31Å; K197-F208 WeakPolarHBondContact CA-O 3.34Å; Y199-F208 WeakPolarHBondContact CD2-O 3.41Å; Y199-F208 PolarHBondContact N-O 3.36Å; Y199-F208 VanDerWaalsContact N-O 3.16Å; Y199-F208 PolarHBondContact O-N 3.46Å; K206-F208 HydrophobicContact CB-CE2 4.02Å; K206-F208 HydrophobicContact CB-CZ 4.13Å; F208-Y210 VanDerWaalsContact C-N 3.29Å; F208-A213 HydrophobicContact CB-CB 4.46Å; F208-A213 HydrophobicContact CD1-CB 4.05Å; F208-F214 HydrophobicContact CB-CB 4.12Å; F208-F214 HydrophobicContact CD2-CB 3.95Å; F208-F214 AromaticContact CD2-CD2 3.8Å; F208-F214 HydrophobicContact CD2-CD2 3.8Å; F208-F214 HydrophobicContact CD2-CG 4.37Å; F208-F214 HydrophobicContact CE2-CD2 4.16Å; F208-F214 HydrophobicContact CG-CB 4.17Å; F208-H217 HydrophobicContact CE1-CB 3.88Å; F208-H217 HydrophobicContact CE2-CB 3.76Å; F208-H217 AromaticContact CE2-CD2 3.42Å; F208-H217 VanDerWaalsContact CE2-CD2 3.42Å; F208-H217 WeakPolarHBondContact CE2-CD2 3.49Å; F208-H217 AromaticContact CE2-CG 3.53Å; F208-H217 HydrophobicContact CZ-CB 3.34Å; F208-H217 AromaticContact CZ-CD2 3.54Å; F208-H217 AromaticContact CZ-CG 3.16Å; F208-H217 AromaticContact CZ-ND1 3.6Å
209	S	92.1	Very high	94.1	Very high	20 Å²	20	65.5 Å²	65.5	14%	0.14	35%	0.354	C	S	.	.	S	Bend	trans	-80.4	-12.2	176.4	-53.6	0	0	0	0	113.1	R191 E196 K197	R191-S209 PolarHBondContact NH1-O 3.3Å; E196-S209 WeakPolarHBondContact O-CB 3.33Å; E196-S209 PolarHBondContact O-OG 3.44Å; K197-S209 WeakPolarHBondContact CG-OG 3.31Å
210	Y	90.1	Very high	94	Very high	101 Å²	101	67.5 Å²	67.5	40%	0.396	37%	0.369	S	S	.	.	S	Bend	trans	-131.3	134.1	-175.3	-56	-88.4	0	0	0	111.6	N188 Y199 F208 A212 A213 F214	N188-Y210 HydrophobicContact CB-CE1 3.81Å; Y199-Y210 VanDerWaalsContact CD2-C 3.46Å; F208-Y210 VanDerWaalsContact C-N 3.29Å; Y210-A212 VanDerWaalsContact C-N 3.35Å; Y210-A212 PolarHBondContact O-N 3Å; Y210-A213 PolarHBondContact O-N 3.23Å; Y210-F214 PolarHBondContact O-N 3.27Å; Y210-F214 VanDerWaalsContact O-N 3.11Å
211	C	91.4	Very high	93.9	Very high	53 Å²	53	63.7 Å²	63.7	36%	0.358	35%	0.353	S	S	.	.	H	α-helix	trans	-58.8	-43.9	177.4	-174	0	0	0	0	112.1	Y199 A213 F214 I215	Y199-C211 HydrophobicContact CD1-CB 4.02Å; Y199-C211 HydrophobicContact CE1-CB 3.52Å; Y199-C211 HydrophobicContact CE2-CB 4.1Å; Y199-C211 VanDerWaalsContact CE2-N 3.29Å; Y199-C211 HydrophobicContact CG-CB 4.49Å; C211-A213 VanDerWaalsContact C-N 3.31Å; C211-A213 PolarHBondContact O-N 3.38Å; C211-F214 WeakPolarHBondContact O-CA 3.35Å; C211-F214 WeakPolarHBondContact O-CB 3.44Å; C211-F214 PolarHBondContact O-N 3.41Å; C211-F214 VanDerWaalsContact O-N 3.09Å; C211-I215 WeakPolarHBondContact O-CG1 3.12Å; C211-I215 PolarHBondContact O-N 3.24Å
212	A	91.4	Very high	93.8	Very high	78 Å²	78	67.5 Å²	67.5	65%	0.645	38%	0.376	S	S	*	.	H	α-helix	trans	-61	-39.2	-179.9	0	0	0	0	0	112.8	Y210 F214 Q216	Y210-A212 VanDerWaalsContact C-N 3.35Å; Y210-A212 PolarHBondContact O-N 3Å; A212-F214 VanDerWaalsContact C-N 3.35Å; A212-Q216 VanDerWaalsContact O-CB 3.31Å; A212-Q216 WeakPolarHBondContact O-CB 3.29Å; A212-Q216 PolarHBondContact O-N 3.18Å
213	A	93.8	Very high	93.7	Very high	31 Å²	31	64.3 Å²	64.3	26%	0.256	36%	0.361	S	S	.	.	H	α-helix	trans	-67.7	-37.6	175.6	0	0	0	0	0	111.5	F208 Y210 C211 Q216 H217	F208-A213 HydrophobicContact CB-CB 4.46Å; F208-A213 HydrophobicContact CD1-CB 4.05Å; Y210-A213 PolarHBondContact O-N 3.23Å; C211-A213 VanDerWaalsContact C-N 3.31Å; C211-A213 PolarHBondContact O-N 3.38Å; A213-Q216 PolarHBondContact O-N 3.16Å; A213-H217 WeakPolarHBondContact O-CB 3.22Å; A213-H217 PolarHBondContact O-N 3.15Å
214	F	95.4	Very high	93.8	Very high	33 Å²	33	64.2 Å²	64.2	15%	0.145	36%	0.361	C	S	.	.	H	α-helix	trans	-64	-49.3	174.3	171.7	-115	0	0	0	112.5	Y199 C201 F208 Y210 C211 A212 Q216 H217 Q218	Y199-F214 HydrophobicContact CG-CB 4.36Å; C201-F214 HydrophobicContact CB-CD2 4.49Å; C201-F214 HydrophobicContact CB-CE2 3.88Å; F208-F214 HydrophobicContact CB-CB 4.12Å; F208-F214 HydrophobicContact CD2-CB 3.95Å; F208-F214 AromaticContact CD2-CD2 3.8Å; F208-F214 HydrophobicContact CD2-CD2 3.8Å; F208-F214 HydrophobicContact CD2-CG 4.37Å; F208-F214 HydrophobicContact CE2-CD2 4.16Å; F208-F214 HydrophobicContact CG-CB 4.17Å; Y210-F214 PolarHBondContact O-N 3.27Å; Y210-F214 VanDerWaalsContact O-N 3.11Å; C211-F214 WeakPolarHBondContact O-CA 3.35Å; C211-F214 WeakPolarHBondContact O-CB 3.44Å; C211-F214 PolarHBondContact O-N 3.41Å; C211-F214 VanDerWaalsContact O-N 3.09Å; A212-F214 VanDerWaalsContact C-N 3.35Å; F214-Q216 VanDerWaalsContact C-N 3.29Å; F214-Q216 PolarHBondContact O-N 2.8Å; F214-H217 WeakPolarHBondContact O-CA 3.37Å; F214-H217 WeakPolarHBondContact O-CB 3.43Å; F214-H217 PolarHBondContact O-N 2.79Å; F214-Q218 HydrophobicContact CD2-CG 4.36Å; F214-Q218 HydrophobicContact CE1-CG 4.29Å; F214-Q218 HydrophobicContact CE2-CG 3.85Å; F214-Q218 VanDerWaalsContact CZ-CD 3.44Å; F214-Q218 HydrophobicContact CZ-CG 3.83Å; F214-Q218 VanDerWaalsContact CZ-NE2 3.34Å; F214-Q218 PolarHBondContact O-N 2.89Å
215	I	93.8	Very high	93.8	Very high	81 Å²	81	67.6 Å²	67.6	42%	0.415	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-42.7	176.5	-66.7	169.2	0	0	0	110.5	C211 H217 Q218	C211-I215 WeakPolarHBondContact O-CG1 3.12Å; C211-I215 PolarHBondContact O-N 3.24Å; I215-H217 VanDerWaalsContact C-N 3.3Å; I215-H217 PolarHBondContact O-N 3.12Å; I215-Q218 PolarHBondContact O-N 3.17Å
216	Q	94.9	Very high	93.8	Very high	79 Å²	79	69.2 Å²	69.2	37%	0.369	37%	0.372	S	S	.	.	H	α-helix	trans	-61.8	-39.3	175.2	-178.4	-177.4	50	0	0	111.9	A212 A213 F214 R219 Q238	A212-Q216 VanDerWaalsContact O-CB 3.31Å; A212-Q216 WeakPolarHBondContact O-CB 3.29Å; A212-Q216 PolarHBondContact O-N 3.18Å; A213-Q216 PolarHBondContact O-N 3.16Å; F214-Q216 VanDerWaalsContact C-N 3.29Å; F214-Q216 PolarHBondContact O-N 2.8Å; Q216-R219 WeakPolarHBondContact O-CB 3.42Å; Q216-R219 PolarHBondContact O-N 3.3Å; Q216-Q238 HydrophobicContact CG-CG 4.44Å; Q216-Q238 VanDerWaalsContact NE2-NE2 3.18Å; Q216-Q238 VanDerWaalsContact NE2-OE1 3.11Å
217	H	95.5	Very high	94	Very high	18 Å²	18	67 Å²	67	8%	0.083	36%	0.361	C	S	.	.	H	α-helix	trans	-65.6	-40.4	176.2	170.3	71.3	0	0	0	112.5	C204 F208 A213 F214 I215 R219 I220 H221	C204-H217 PolarHBondContact SG-NE2 2.76Å; F208-H217 HydrophobicContact CE1-CB 3.88Å; F208-H217 HydrophobicContact CE2-CB 3.76Å; F208-H217 AromaticContact CE2-CD2 3.42Å; F208-H217 VanDerWaalsContact CE2-CD2 3.42Å; F208-H217 WeakPolarHBondContact CE2-CD2 3.49Å; F208-H217 AromaticContact CE2-CG 3.53Å; F208-H217 HydrophobicContact CZ-CB 3.34Å; F208-H217 AromaticContact CZ-CD2 3.54Å; F208-H217 AromaticContact CZ-CG 3.16Å; F208-H217 AromaticContact CZ-ND1 3.6Å; A213-H217 WeakPolarHBondContact O-CB 3.22Å; A213-H217 PolarHBondContact O-N 3.15Å; F214-H217 WeakPolarHBondContact O-CA 3.37Å; F214-H217 WeakPolarHBondContact O-CB 3.43Å; F214-H217 PolarHBondContact O-N 2.79Å; I215-H217 VanDerWaalsContact C-N 3.3Å; I215-H217 PolarHBondContact O-N 3.12Å; H217-R219 PolarHBondContact O-N 3.39Å; H217-R219 VanDerWaalsContact O-N 3.09Å; H217-I220 VanDerWaalsContact O-CB 3.26Å; H217-I220 WeakPolarHBondContact O-CB 3.41Å; H217-I220 WeakPolarHBondContact O-CG1 3.33Å; H217-I220 PolarHBondContact O-N 3.09Å; H217-H221 AromaticContact CE1-NE2 3.9Å; H217-H221 AromaticContact NE2-NE2 3.34Å; H217-H221 PolarHBondContact NE2-NE2 2.82Å
218	Q	94.9	Very high	94	Very high	66 Å²	66	73.8 Å²	73.8	31%	0.308	38%	0.38	S	S	.	.	H	α-helix	trans	-57.9	-25.5	177.9	-72.8	-176.2	-58.5	0	0	113.1	F214 I215 I220 H221 T222	F214-Q218 HydrophobicContact CD2-CG 4.36Å; F214-Q218 HydrophobicContact CE1-CG 4.29Å; F214-Q218 HydrophobicContact CE2-CG 3.85Å; F214-Q218 VanDerWaalsContact CZ-CD 3.44Å; F214-Q218 HydrophobicContact CZ-CG 3.83Å; F214-Q218 VanDerWaalsContact CZ-NE2 3.34Å; F214-Q218 PolarHBondContact O-N 2.89Å; I215-Q218 PolarHBondContact O-N 3.17Å; Q218-I220 PolarHBondContact O-N 3.41Å; Q218-H221 PolarHBondContact O-N 3.09Å; Q218-H221 VanDerWaalsContact O-N 3.13Å; Q218-T222 PolarHBondContact O-N 2.86Å; Q218-T222 VanDerWaalsContact O-N 3.12Å; Q218-T222 PolarHBondContact O-OG1 3.12Å; Q218-T222 VanDerWaalsContact O-OG1 3.12Å
219	R	95.1	Very high	94.2	Very high	58 Å²	58	71.8 Å²	71.8	22%	0.219	37%	0.371	C	S	.	.	H	α-helix	trans	-62.6	-20	173.6	-62.7	-176	-179.7	157.6	5.4	114.2	Q216 H217 H221 T222 G223 E224 S237	Q216-R219 WeakPolarHBondContact O-CB 3.42Å; Q216-R219 PolarHBondContact O-N 3.3Å; H217-R219 PolarHBondContact O-N 3.39Å; H217-R219 VanDerWaalsContact O-N 3.09Å; R219-H221 VanDerWaalsContact C-N 3.34Å; R219-T222 WeakPolarHBondContact CA-OG1 3.46Å; R219-G223 WeakPolarHBondContact O-CA 3.4Å; R219-G223 PolarHBondContact O-N 3.3Å; R219-G223 VanDerWaalsContact O-N 3.1Å; R219-E224 HydrophobicContact CG-CB 4.3Å; R219-E224 PolarHBondContact O-N 3.1Å; R219-S237 PolarHBondContact NH1-O 3.27Å
220	I	94.3	Very high	94.3	Very high	119 Å²	119	75.9 Å²	75.9	61%	0.61	41%	0.406	S	S	*	.	H	α-helix	trans	-68.1	-40.1	175.8	-61.8	176.5	0	0	0	110	H217 Q218	H217-I220 VanDerWaalsContact O-CB 3.26Å; H217-I220 WeakPolarHBondContact O-CB 3.41Å; H217-I220 WeakPolarHBondContact O-CG1 3.33Å; H217-I220 PolarHBondContact O-N 3.09Å; Q218-I220 PolarHBondContact O-N 3.41Å
221	H	94.2	Very high	94.5	Very high	68 Å²	68	74.9 Å²	74.9	32%	0.315	42%	0.419	S	S	.	.	H	α-helix	trans	-84.4	-42.8	-176.8	-52.2	-49.5	0	0	0	112.7	C201 E203 H217 Q218 R219 G223	C201-H221 PolarHBondContact SG-NE2 3.46Å; E203-H221 IonicContact OE1-CD2 3.47Å; E203-H221 WeakPolarHBondContact OE2-CB 3.45Å; E203-H221 IonicContact OE2-CD2 3.47Å; E203-H221 PolarHBondContact OE2-CD2 3.38Å; E203-H221 IonicContact OE2-CG 3.16Å; E203-H221 IonicContact OE2-ND1 3.77Å; H217-H221 AromaticContact CE1-NE2 3.9Å; H217-H221 AromaticContact NE2-NE2 3.34Å; H217-H221 PolarHBondContact NE2-NE2 2.82Å; Q218-H221 PolarHBondContact O-N 3.09Å; Q218-H221 VanDerWaalsContact O-N 3.13Å; R219-H221 VanDerWaalsContact C-N 3.34Å; H221-G223 PolarHBondContact O-N 2.83Å
222	T	93.3	Very high	94.7	Very high	82 Å²	82	75.1 Å²	75.1	50%	0.503	42%	0.42	S	S	.	.	H	α-helix	trans	-69.9	-18.1	176.1	57.5	0	0	0	0	112.7	Q218 R219 E224	Q218-T222 PolarHBondContact O-N 2.86Å; Q218-T222 VanDerWaalsContact O-N 3.12Å; Q218-T222 PolarHBondContact O-OG1 3.12Å; Q218-T222 VanDerWaalsContact O-OG1 3.12Å; R219-T222 WeakPolarHBondContact CA-OG1 3.46Å; T222-E224 PolarHBondContact O-N 3.43Å; T222-E224 PolarHBondContact OG1-N 2.87Å
223	G	93	Very high	94.8	Very high	45 Å²	45	72.9 Å²	72.9	46%	0.464	41%	0.405	S	S	.	.			trans	69.7	7	-174.5	0	0	0	0	0	114	R219 H221 K225	R219-G223 WeakPolarHBondContact O-CA 3.4Å; R219-G223 PolarHBondContact O-N 3.3Å; R219-G223 VanDerWaalsContact O-N 3.1Å; H221-G223 PolarHBondContact O-N 2.83Å; G223-K225 PolarHBondContact O-N 3.45Å
224	E	94.3	Very high	94.9	Very high	115 Å²	115	77.7 Å²	77.7	54%	0.537	42%	0.42	S	S	.	.			trans	-59.5	125.1	-179.1	-77.8	-171.3	176.2	0	0	111.9	R219 T222	R219-E224 HydrophobicContact CG-CB 4.3Å; R219-E224 PolarHBondContact O-N 3.1Å; T222-E224 PolarHBondContact O-N 3.43Å; T222-E224 PolarHBondContact OG1-N 2.87Å
225	K	95.4	Very high	95	Very high	126 Å²	126	77.4 Å²	77.4	55%	0.548	42%	0.424	S	S	.	.			trans	-128.6	77.6	178.9	-72	168.3	177.1	-177.9	0	110.2	G223 Y227 A235 F236	G223-K225 PolarHBondContact O-N 3.45Å; K225-Y227 PolarHBondContact O-N 3.46Å; K225-Y227 VanDerWaalsContact O-N 3.11Å; K225-A235 HydrophobicContact CB-CB 3.59Å; K225-A235 HydrophobicContact CD-CB 4.3Å; K225-A235 WeakPolarHBondContact CD-O 3.29Å; K225-F236 CarbonylContact C-O 3.52Å; K225-F236 VanDerWaalsContact C-O 3.23Å; K225-F236 VanDerWaalsContact CA-O 3.28Å; K225-F236 WeakPolarHBondContact CA-O 3.49Å
226	P	94.7	Very high	95.1	Very high	74 Å²	74	75.6 Å²	75.6	48%	0.481	41%	0.413	S	S	.	.			trans	-63.9	-20	-173	-23.2	34.8	0	0	0	114.1
227	Y	97	Very high	95	Very high	82 Å²	82	73.3 Å²	73.3	32%	0.322	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	99.3	-171.2	-56.2	-78	0	0	0	110.6	K225 A235 F236	K225-Y227 PolarHBondContact O-N 3.46Å; K225-Y227 VanDerWaalsContact O-N 3.11Å; Y227-A235 CarbonylContact O-C 3.59Å; Y227-A235 WeakPolarHBondContact O-CA 3.38Å; Y227-F236 WeakPolarHBondContact CB-O 3.49Å; Y227-F236 WeakPolarHBondContact CD2-O 2.96Å; Y227-F236 PolarHBondContact N-O 3.07Å; Y227-F236 VanDerWaalsContact N-O 3.1Å; Y227-F236 PolarHBondContact O-N 3.5Å
228	R	96.5	Very high	95	Very high	177 Å²	177	75.6 Å²	75.6	67%	0.668	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.5	-179.2	-171.1	177.9	-78.2	-107.4	9.7	112	G233	R228-G233 WeakPolarHBondContact CG-O 3.32Å; R228-G233 PolarHBondContact NH1-O 2.77Å; R228-G233 VanDerWaalsContact NH1-O 3.07Å
229	C	96.8	Very high	95	Very high	2 Å²	2	75.4 Å²	75.4	1%	0.014	42%	0.423	C	S	.	.			trans	-77.2	122	170.5	-174.6	0	0	0	0	110.1	A231 G233 K234 L242	C229-A231 VanDerWaalsContact C-N 3.31Å; C229-A231 PolarHBondContact O-N 3.29Å; C229-G233 WeakPolarHBondContact O-CA 3.46Å; C229-G233 PolarHBondContact O-N 3.33Å; C229-K234 WeakPolarHBondContact CB-O 3.44Å; C229-K234 PolarHBondContact N-O 3.35Å; C229-L242 HydrophobicContact CB-CD1 3.6Å
230	A	95	Very high	95	Very high	105 Å²	105	75 Å²	75	87%	0.868	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-33.4	177.9	0	0	0	0	0	112.9
231	A	94.2	Very high	95	Very high	81 Å²	81	72.6 Å²	72.6	67%	0.669	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-34.4	-174.5	0	0	0	0	0	114.2	C229	C229-A231 VanDerWaalsContact C-N 3.31Å; C229-A231 PolarHBondContact O-N 3.29Å
232	C	95.4	Very high	95.1	Very high	57 Å²	57	70.3 Å²	70.3	39%	0.385	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	4.3	-174.4	71.3	0	0	0	0	114.1	K234 H245	C232-K234 PolarHBondContact O-N 3.39Å; C232-H245 PolarHBondContact SG-NE2 3.48Å
233	G	94	Very high	95.2	Very high	32 Å²	32	69.6 Å²	69.6	33%	0.33	41%	0.406	S	S	.	.			trans	69.9	-5.9	-179.8	0	0	0	0	0	115.7	R228 C229 A235	R228-G233 WeakPolarHBondContact CG-O 3.32Å; R228-G233 PolarHBondContact NH1-O 2.77Å; R228-G233 VanDerWaalsContact NH1-O 3.07Å; C229-G233 WeakPolarHBondContact O-CA 3.46Å; C229-G233 PolarHBondContact O-N 3.33Å; G233-A235 PolarHBondContact O-N 3.08Å
234	K	95.7	Very high	95.3	Very high	131 Å²	131	69.5 Å²	69.5	57%	0.57	40%	0.395	S	S	*	.			trans	-62.8	134.3	179.6	-73.5	-176	178.2	178.6	0	111.2	C229 C232 F236	C229-K234 WeakPolarHBondContact CB-O 3.44Å; C229-K234 PolarHBondContact N-O 3.35Å; C232-K234 PolarHBondContact O-N 3.39Å; K234-F236 HydrophobicContact CB-CE2 4.07Å; K234-F236 HydrophobicContact CB-CZ 4.22Å
235	A	96.1	Very high	95.3	Very high	28 Å²	28	65.3 Å²	65.3	23%	0.231	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147.6	-177.9	0	0	0	0	0	112.4	K225 Y227 G233	K225-A235 HydrophobicContact CB-CB 3.59Å; K225-A235 HydrophobicContact CD-CB 4.3Å; K225-A235 WeakPolarHBondContact CD-O 3.29Å; Y227-A235 CarbonylContact O-C 3.59Å; Y227-A235 WeakPolarHBondContact O-CA 3.38Å; G233-A235 PolarHBondContact O-N 3.08Å
236	F	95.8	Very high	95.3	Very high	43 Å²	43	63.2 Å²	63.2	19%	0.189	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.1	-176.5	-57.9	-90.4	0	0	0	110.9	K225 Y227 K234 Q238 N241 L242 H245	K225-F236 CarbonylContact C-O 3.52Å; K225-F236 VanDerWaalsContact C-O 3.23Å; K225-F236 VanDerWaalsContact CA-O 3.28Å; K225-F236 WeakPolarHBondContact CA-O 3.49Å; Y227-F236 WeakPolarHBondContact CB-O 3.49Å; Y227-F236 WeakPolarHBondContact CD2-O 2.96Å; Y227-F236 PolarHBondContact N-O 3.07Å; Y227-F236 VanDerWaalsContact N-O 3.1Å; Y227-F236 PolarHBondContact O-N 3.5Å; K234-F236 HydrophobicContact CB-CE2 4.07Å; K234-F236 HydrophobicContact CB-CZ 4.22Å; F236-Q238 VanDerWaalsContact C-N 3.31Å; F236-N241 HydrophobicContact CB-CB 4.2Å; F236-N241 HydrophobicContact CD1-CB 3.89Å; F236-N241 HydrophobicContact CG-CB 4.28Å; F236-L242 HydrophobicContact CB-CB 4.36Å; F236-L242 HydrophobicContact CD2-CB 3.85Å; F236-L242 HydrophobicContact CD2-CD1 3.83Å; F236-L242 HydrophobicContact CD2-CG 4.45Å; F236-L242 HydrophobicContact CE2-CD1 3.96Å; F236-L242 HydrophobicContact CG-CB 4.29Å; F236-H245 HydrophobicContact CE1-CB 3.97Å; F236-H245 HydrophobicContact CE2-CB 3.81Å; F236-H245 AromaticContact CE2-CD2 3.4Å; F236-H245 VanDerWaalsContact CE2-CD2 3.4Å; F236-H245 WeakPolarHBondContact CE2-CD2 3.35Å; F236-H245 AromaticContact CE2-CG 3.68Å; F236-H245 HydrophobicContact CZ-CB 3.37Å; F236-H245 AromaticContact CZ-CD2 3.44Å; F236-H245 VanDerWaalsContact CZ-CD2 3.44Å; F236-H245 WeakPolarHBondContact CZ-CD2 3.46Å; F236-H245 AromaticContact CZ-CG 3.25Å; F236-H245 AromaticContact CZ-ND1 3.93Å
237	S	94.8	Very high	95.3	Very high	31 Å²	31	61.6 Å²	61.6	22%	0.217	35%	0.351	C	S	.	.	S	Bend	trans	-79.9	-13.5	177.2	56.3	0	0	0	0	113.4	R219	R219-S237 PolarHBondContact NH1-O 3.27Å
238	Q	94.7	Very high	95.2	Very high	66 Å²	66	62.1 Å²	62.1	31%	0.308	36%	0.363	S	S	.	.	S	Bend	trans	-135.2	141.2	-178	-49.3	-175.7	23.7	0	0	110.7	Q216 F236 N241 L242	Q216-Q238 HydrophobicContact CG-CG 4.44Å; Q216-Q238 VanDerWaalsContact NE2-NE2 3.18Å; Q216-Q238 VanDerWaalsContact NE2-OE1 3.11Å; F236-Q238 VanDerWaalsContact C-N 3.31Å; Q238-N241 HydrophobicContact CB-CB 4.45Å; Q238-N241 PolarHBondContact O-N 2.98Å; Q238-L242 PolarHBondContact O-N 3.12Å
239	S	95.3	Very high	95	Very high	61 Å²	61	58 Å²	58	43%	0.427	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-42.6	179.5	53.7	0	0	0	0	112.4	N241 L242 T243	S239-N241 PolarHBondContact O-N 2.91Å; S239-L242 WeakPolarHBondContact O-CA 3.4Å; S239-L242 WeakPolarHBondContact O-CB 2.86Å; S239-L242 PolarHBondContact O-N 2.97Å; S239-T243 PolarHBondContact O-N 3.3Å; S239-T243 PolarHBondContact O-OG1 3.18Å
240	A	93.6	Very high	94.8	Very high	51 Å²	51	62.6 Å²	62.6	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-58.3	-36.1	178.4	0	0	0	0	0	112.5	T243 N244	A240-T243 PolarHBondContact O-N 3.48Å; A240-N244 WeakPolarHBondContact O-CB 3.47Å; A240-N244 VanDerWaalsContact O-CG 3.28Å; A240-N244 PolarHBondContact O-N 2.87Å; A240-N244 PolarHBondContact O-ND2 3.12Å
241	N	95.1	Very high	94.7	Very high	67 Å²	67	60 Å²	60	36%	0.358	36%	0.363	S	S	.	.	H	α-helix	trans	-69.1	-38.1	176.2	-68.8	-14.6	0	0	0	111.5	F236 Q238 S239 H245	F236-N241 HydrophobicContact CB-CB 4.2Å; F236-N241 HydrophobicContact CD1-CB 3.89Å; F236-N241 HydrophobicContact CG-CB 4.28Å; Q238-N241 HydrophobicContact CB-CB 4.45Å; Q238-N241 PolarHBondContact O-N 2.98Å; S239-N241 PolarHBondContact O-N 2.91Å; N241-H245 VanDerWaalsContact O-CB 3.28Å; N241-H245 WeakPolarHBondContact O-CB 3.49Å; N241-H245 PolarHBondContact O-N 3.04Å
242	L	96.2	Very high	94.7	Very high	21 Å²	21	61.1 Å²	61.1	11%	0.11	36%	0.355	C	S	.	.	H	α-helix	trans	-62.8	-46.7	172.1	171.7	62.7	0	0	0	110.9	C229 F236 Q238 S239 N244 H245 Q246	C229-L242 HydrophobicContact CB-CD1 3.6Å; F236-L242 HydrophobicContact CB-CB 4.36Å; F236-L242 HydrophobicContact CD2-CB 3.85Å; F236-L242 HydrophobicContact CD2-CD1 3.83Å; F236-L242 HydrophobicContact CD2-CG 4.45Å; F236-L242 HydrophobicContact CE2-CD1 3.96Å; F236-L242 HydrophobicContact CG-CB 4.29Å; Q238-L242 PolarHBondContact O-N 3.12Å; S239-L242 WeakPolarHBondContact O-CA 3.4Å; S239-L242 WeakPolarHBondContact O-CB 2.86Å; S239-L242 PolarHBondContact O-N 2.97Å; L242-N244 PolarHBondContact O-N 2.94Å; L242-H245 CarbonylContact O-C 3.55Å; L242-H245 WeakPolarHBondContact O-CB 3.39Å; L242-H245 PolarHBondContact O-N 3.32Å; L242-H245 VanDerWaalsContact O-N 3.15Å; L242-Q246 HydrophobicContact CD1-CG 4.12Å; L242-Q246 HydrophobicContact CG-CG 4.45Å; L242-Q246 WeakPolarHBondContact O-CG 3.3Å; L242-Q246 PolarHBondContact O-N 3.3Å
243	T	95.2	Very high	94.7	Very high	66 Å²	66	64 Å²	64	41%	0.405	36%	0.361	S	S	.	.	H	α-helix	trans	-59.7	-46.2	177.8	-56.1	0	0	0	0	111.6	S239 A240 H245 Q246 R247	S239-T243 PolarHBondContact O-N 3.3Å; S239-T243 PolarHBondContact O-OG1 3.18Å; A240-T243 PolarHBondContact O-N 3.48Å; T243-H245 VanDerWaalsContact C-N 3.29Å; T243-H245 PolarHBondContact O-N 2.92Å; T243-Q246 PolarHBondContact O-N 2.76Å; T243-R247 PolarHBondContact O-N 3.38Å
244	N	94.4	Very high	94.7	Very high	43 Å²	43	65.2 Å²	65.2	23%	0.23	36%	0.363	C	S	.	.	H	α-helix	trans	-63.2	-36.5	175.9	-73.2	-23	0	0	0	112.1	A240 L242 R247	A240-N244 WeakPolarHBondContact O-CB 3.47Å; A240-N244 VanDerWaalsContact O-CG 3.28Å; A240-N244 PolarHBondContact O-N 2.87Å; A240-N244 PolarHBondContact O-ND2 3.12Å; L242-N244 PolarHBondContact O-N 2.94Å; N244-R247 WeakPolarHBondContact O-CB 3.5Å; N244-R247 PolarHBondContact O-N 3.27Å; N244-R247 PolarHBondContact OD1-NH1 3.2Å
245	H	95.3	Very high	94.8	Very high	27 Å²	27	62.6 Å²	62.6	13%	0.125	35%	0.35	C	S	.	.	H	α-helix	trans	-67.2	-40	173.8	172.7	58.9	0	0	0	112.2	C232 F236 N241 L242 T243 R247 T248 H249	C232-H245 PolarHBondContact SG-NE2 3.48Å; F236-H245 HydrophobicContact CE1-CB 3.97Å; F236-H245 HydrophobicContact CE2-CB 3.81Å; F236-H245 AromaticContact CE2-CD2 3.4Å; F236-H245 VanDerWaalsContact CE2-CD2 3.4Å; F236-H245 WeakPolarHBondContact CE2-CD2 3.35Å; F236-H245 AromaticContact CE2-CG 3.68Å; F236-H245 HydrophobicContact CZ-CB 3.37Å; F236-H245 AromaticContact CZ-CD2 3.44Å; F236-H245 VanDerWaalsContact CZ-CD2 3.44Å; F236-H245 WeakPolarHBondContact CZ-CD2 3.46Å; F236-H245 AromaticContact CZ-CG 3.25Å; F236-H245 AromaticContact CZ-ND1 3.93Å; N241-H245 VanDerWaalsContact O-CB 3.28Å; N241-H245 WeakPolarHBondContact O-CB 3.49Å; N241-H245 PolarHBondContact O-N 3.04Å; L242-H245 CarbonylContact O-C 3.55Å; L242-H245 WeakPolarHBondContact O-CB 3.39Å; L242-H245 PolarHBondContact O-N 3.32Å; L242-H245 VanDerWaalsContact O-N 3.15Å; T243-H245 VanDerWaalsContact C-N 3.29Å; T243-H245 PolarHBondContact O-N 2.92Å; H245-R247 PolarHBondContact O-N 2.97Å; H245-T248 PolarHBondContact ND1-OG1 3.47Å; H245-T248 WeakPolarHBondContact O-CB 3.45Å; H245-T248 PolarHBondContact O-N 3.07Å; H245-T248 PolarHBondContact O-OG1 2.76Å; H245-H249 AromaticContact CD2-NE2 3.86Å; H245-H249 AromaticContact CE1-CE1 3.94Å; H245-H249 AromaticContact CE1-NE2 3.44Å; H245-H249 PolarHBondContact CE1-NE2 2.81Å; H245-H249 AromaticContact NE2-CD2 3.93Å; H245-H249 AromaticContact NE2-CE1 3.86Å; H245-H249 AromaticContact NE2-NE2 3.03Å; H245-H249 PolarHBondContact NE2-NE2 3.46Å
246	Q	95.1	Very high	94.8	Very high	83 Å²	83	68.7 Å²	68.7	39%	0.388	37%	0.371	S	S	.	.	H	α-helix	trans	-58.3	-32.8	178.1	-75.9	170.2	-39	0	0	112.2	L242 T243 T248 H249 T250	L242-Q246 HydrophobicContact CD1-CG 4.12Å; L242-Q246 HydrophobicContact CG-CG 4.45Å; L242-Q246 WeakPolarHBondContact O-CG 3.3Å; L242-Q246 PolarHBondContact O-N 3.3Å; T243-Q246 PolarHBondContact O-N 2.76Å; Q246-T248 PolarHBondContact O-N 3.5Å; Q246-T248 VanDerWaalsContact O-N 3.17Å; Q246-H249 WeakPolarHBondContact O-CB 3.34Å; Q246-H249 PolarHBondContact O-N 3.23Å; Q246-T250 PolarHBondContact O-N 3.1Å
247	R	94.9	Very high	94.8	Very high	39 Å²	39	66.8 Å²	66.8	15%	0.147	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-22	173.3	-63.2	-179.5	-179.5	153.9	4.5	113.9	T243 N244 H245 H249 T250 G251 E252 S265	T243-R247 PolarHBondContact O-N 3.38Å; N244-R247 WeakPolarHBondContact O-CB 3.5Å; N244-R247 PolarHBondContact O-N 3.27Å; N244-R247 PolarHBondContact OD1-NH1 3.2Å; H245-R247 PolarHBondContact O-N 2.97Å; R247-H249 VanDerWaalsContact C-N 3.29Å; R247-T250 WeakPolarHBondContact CA-OG1 3.35Å; R247-G251 WeakPolarHBondContact O-CA 3.47Å; R247-G251 PolarHBondContact O-N 3.1Å; R247-E252 HydrophobicContact CG-CB 4.35Å; R247-E252 PolarHBondContact O-N 3.45Å; R247-S265 WeakPolarHBondContact CD-O 3.35Å; R247-S265 PolarHBondContact NH1-O 3.49Å
248	T	94.1	Very high	94.8	Very high	93 Å²	93	70.5 Å²	70.5	57%	0.571	39%	0.389	S	S	*	.	H	α-helix	trans	-74	-23.5	174.8	72.2	0	0	0	0	112.6	H245 Q246	H245-T248 PolarHBondContact ND1-OG1 3.47Å; H245-T248 WeakPolarHBondContact O-CB 3.45Å; H245-T248 PolarHBondContact O-N 3.07Å; H245-T248 PolarHBondContact O-OG1 2.76Å; Q246-T248 PolarHBondContact O-N 3.5Å; Q246-T248 VanDerWaalsContact O-N 3.17Å
249	H	93.6	Very high	94.8	Very high	90 Å²	90	72.8 Å²	72.8	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-84.2	-42.1	175.3	-60.7	-56.6	0	0	0	111.2	H245 Q246 R247	H245-H249 AromaticContact CD2-NE2 3.86Å; H245-H249 AromaticContact CE1-CE1 3.94Å; H245-H249 AromaticContact CE1-NE2 3.44Å; H245-H249 PolarHBondContact CE1-NE2 2.81Å; H245-H249 AromaticContact NE2-CD2 3.93Å; H245-H249 AromaticContact NE2-CE1 3.86Å; H245-H249 AromaticContact NE2-NE2 3.03Å; H245-H249 PolarHBondContact NE2-NE2 3.46Å; Q246-H249 WeakPolarHBondContact O-CB 3.34Å; Q246-H249 PolarHBondContact O-N 3.23Å; R247-H249 VanDerWaalsContact C-N 3.29Å
250	T	93.2	Very high	94.7	Very high	100 Å²	100	72.5 Å²	72.5	61%	0.613	40%	0.397	S	S	*	.	H	α-helix	trans	-81.1	-17.5	-178.4	62.4	0	0	0	0	113.3	Q246 R247 E252	Q246-T250 PolarHBondContact O-N 3.1Å; R247-T250 WeakPolarHBondContact CA-OG1 3.35Å; T250-E252 PolarHBondContact O-N 3.19Å; T250-E252 WeakPolarHBondContact OG1-CB 3.41Å; T250-E252 PolarHBondContact OG1-N 3.11Å
251	G	92.4	Very high	94.7	Very high	50 Å²	50	72.6 Å²	72.6	52%	0.515	40%	0.403	S	S	.	.			trans	70.2	8.6	-172.1	0	0	0	0	0	113.8	R247 K253	R247-G251 WeakPolarHBondContact O-CA 3.47Å; R247-G251 PolarHBondContact O-N 3.1Å; G251-K253 PolarHBondContact O-N 2.85Å
252	E	94.3	Very high	94.7	Very high	105 Å²	105	75.4 Å²	75.4	49%	0.491	41%	0.412	S	S	.	.			trans	-61.8	126.9	-177.8	-168.4	-166	168.2	0	0	111	R247 T250 P254	R247-E252 HydrophobicContact CG-CB 4.35Å; R247-E252 PolarHBondContact O-N 3.45Å; T250-E252 PolarHBondContact O-N 3.19Å; T250-E252 WeakPolarHBondContact OG1-CB 3.41Å; T250-E252 PolarHBondContact OG1-N 3.11Å; E252-P254 HydrophobicContact CG-CG 4Å; E252-P254 WeakPolarHBondContact OE1-CG 3.44Å
253	K	95.1	Very high	94.7	Very high	117 Å²	117	75.8 Å²	75.8	51%	0.509	42%	0.418	S	S	.	.			trans	-128	79.2	-179.8	-72.1	167.6	170.5	-171.5	0	110.1	G251 Y255 A263 F264	G251-K253 PolarHBondContact O-N 2.85Å; K253-Y255 PolarHBondContact O-N 3.48Å; K253-A263 HydrophobicContact CB-CB 3.56Å; K253-A263 HydrophobicContact CD-CB 4.19Å; K253-A263 WeakPolarHBondContact CD-O 3.3Å; K253-A263 HydrophobicContact CG-CB 4.47Å; K253-F264 CarbonylContact C-O 3.51Å; K253-F264 VanDerWaalsContact C-O 3.26Å; K253-F264 VanDerWaalsContact CA-O 3.27Å; K253-F264 WeakPolarHBondContact CA-O 3.39Å
254	P	94.4	Very high	94.7	Very high	58 Å²	58	74.7 Å²	74.7	38%	0.377	41%	0.408	S	S	.	.			trans	-65.9	-24.1	-173.4	-21.9	34.2	0	0	0	113.7	E252	E252-P254 HydrophobicContact CG-CG 4Å; E252-P254 WeakPolarHBondContact OE1-CG 3.44Å
255	Y	96.6	Very high	94.7	Very high	76 Å²	76	74.1 Å²	74.1	30%	0.298	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	99.6	-170.4	-54.1	-77.2	0	0	0	110	K253 A263 F264	K253-Y255 PolarHBondContact O-N 3.48Å; Y255-A263 CarbonylContact O-C 3.58Å; Y255-A263 WeakPolarHBondContact O-CA 3.36Å; Y255-F264 WeakPolarHBondContact CD2-O 3.38Å; Y255-F264 PolarHBondContact N-O 3.05Å; Y255-F264 VanDerWaalsContact N-O 3.13Å; Y255-F264 PolarHBondContact O-N 3.41Å
256	K	96.2	Very high	94.6	Very high	155 Å²	155	76 Å²	76	67%	0.674	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	135.3	179.7	-62.6	-175.8	-179.6	179.8	0	111	A263	K256-A263 HydrophobicContact CG-CB 3.92Å
257	C	96.4	Very high	94.6	Very high	3 Å²	3	74.5 Å²	74.5	2%	0.02	42%	0.415	C	S	.	.			trans	-74.1	125.4	168.4	179.8	0	0	0	0	109.3	E259 G261 K262 L270 H277	C257-E259 VanDerWaalsContact C-N 3.29Å; C257-E259 PolarHBondContact O-N 2.89Å; C257-E259 PolarHBondContact SG-N 3.49Å; C257-G261 WeakPolarHBondContact O-CA 3.44Å; C257-G261 PolarHBondContact O-N 3.4Å; C257-K262 WeakPolarHBondContact CB-O 3.42Å; C257-K262 PolarHBondContact N-O 3.49Å; C257-L270 HydrophobicContact CB-CD1 3.68Å; C257-H277 PolarHBondContact SG-NE2 2.99Å
258	S	94.6	Very high	94.5	Very high	109 Å²	109	76 Å²	76	76%	0.762	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-27.6	177.2	47	0	0	0	0	113.1
259	E	93.9	Very high	94.5	Very high	115 Å²	115	74.6 Å²	74.6	54%	0.537	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-38.8	-172.9	-63.9	177.7	-138.9	0	0	113.2	C257 H277	C257-E259 VanDerWaalsContact C-N 3.29Å; C257-E259 PolarHBondContact O-N 2.89Å; C257-E259 PolarHBondContact SG-N 3.49Å; E259-H277 WeakPolarHBondContact OE2-CB 3.45Å; E259-H277 IonicContact OE2-CD2 3.04Å; E259-H277 IonicContact OE2-CG 3.91Å; E259-H277 IonicContact OE2-ND1 3.05Å
260	C	94.9	Very high	94.6	Very high	55 Å²	55	71.4 Å²	71.4	37%	0.372	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	5.1	-178.8	71.8	0	0	0	0	114.7	K262 H273 H277	C260-K262 PolarHBondContact O-N 3.35Å; C260-K262 VanDerWaalsContact SG-CG 3.59Å; C260-H273 PolarHBondContact SG-NE2 3.19Å; C260-H277 PolarHBondContact SG-NE2 2.86Å; C260-H277 VanDerWaalsContact SG-NE2 3.35Å
261	G	93.4	Very high	94.6	Very high	53 Å²	53	71.1 Å²	71.1	55%	0.546	40%	0.397	S	S	.	.			trans	70.7	-5.2	179.1	0	0	0	0	0	115.3	C257 A263	C257-G261 WeakPolarHBondContact O-CA 3.44Å; C257-G261 PolarHBondContact O-N 3.4Å; G261-A263 PolarHBondContact O-N 3.04Å
262	K	95.1	Very high	94.6	Very high	125 Å²	125	71.2 Å²	71.2	54%	0.543	39%	0.385	S	S	.	.			trans	-62.4	132.9	179.9	-73.7	-179.7	-177.8	173.4	0	111	C257 C260 F264	C257-K262 WeakPolarHBondContact CB-O 3.42Å; C257-K262 PolarHBondContact N-O 3.49Å; C260-K262 PolarHBondContact O-N 3.35Å; C260-K262 VanDerWaalsContact SG-CG 3.59Å; K262-F264 HydrophobicContact CB-CE2 3.97Å; K262-F264 HydrophobicContact CB-CZ 4.15Å; K262-F264 WeakPolarHBondContact O-CE2 3.31Å
263	A	95.7	Very high	94.6	Very high	30 Å²	30	67.3 Å²	67.3	25%	0.248	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	143.3	-177.8	0	0	0	0	0	112.1	K253 Y255 K256 G261	K253-A263 HydrophobicContact CB-CB 3.56Å; K253-A263 HydrophobicContact CD-CB 4.19Å; K253-A263 WeakPolarHBondContact CD-O 3.3Å; K253-A263 HydrophobicContact CG-CB 4.47Å; Y255-A263 CarbonylContact O-C 3.58Å; Y255-A263 WeakPolarHBondContact O-CA 3.36Å; K256-A263 HydrophobicContact CG-CB 3.92Å; G261-A263 PolarHBondContact O-N 3.04Å
264	F	95	Very high	94.5	Very high	42 Å²	42	64.8 Å²	64.8	18%	0.184	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.9	-177.4	-58.6	-90.7	0	0	0	110.9	K253 Y255 K262 Q266 N269 L270 H273	K253-F264 CarbonylContact C-O 3.51Å; K253-F264 VanDerWaalsContact C-O 3.26Å; K253-F264 VanDerWaalsContact CA-O 3.27Å; K253-F264 WeakPolarHBondContact CA-O 3.39Å; Y255-F264 WeakPolarHBondContact CD2-O 3.38Å; Y255-F264 PolarHBondContact N-O 3.05Å; Y255-F264 VanDerWaalsContact N-O 3.13Å; Y255-F264 PolarHBondContact O-N 3.41Å; K262-F264 HydrophobicContact CB-CE2 3.97Å; K262-F264 HydrophobicContact CB-CZ 4.15Å; K262-F264 WeakPolarHBondContact O-CE2 3.31Å; F264-Q266 VanDerWaalsContact C-N 3.34Å; F264-N269 HydrophobicContact CB-CB 4.22Å; F264-N269 HydrophobicContact CD1-CB 3.86Å; F264-N269 HydrophobicContact CG-CB 4.29Å; F264-L270 HydrophobicContact CB-CB 4.39Å; F264-L270 HydrophobicContact CD2-CB 3.95Å; F264-L270 HydrophobicContact CD2-CD1 3.86Å; F264-L270 HydrophobicContact CE2-CD1 4.03Å; F264-L270 HydrophobicContact CG-CB 4.33Å; F264-H273 HydrophobicContact CE1-CB 3.95Å; F264-H273 HydrophobicContact CE2-CB 3.9Å; F264-H273 AromaticContact CE2-CD2 3.25Å; F264-H273 WeakPolarHBondContact CE2-CD2 3.23Å; F264-H273 AromaticContact CE2-CG 3.66Å; F264-H273 AromaticContact CE2-NE2 3.99Å; F264-H273 HydrophobicContact CZ-CB 3.42Å; F264-H273 VanDerWaalsContact CZ-CB 3.42Å; F264-H273 AromaticContact CZ-CD2 3.31Å; F264-H273 WeakPolarHBondContact CZ-CD2 3.49Å; F264-H273 AromaticContact CZ-CG 3.23Å; F264-H273 AromaticContact CZ-ND1 3.91Å; F264-H273 AromaticContact CZ-NE2 3.94Å
265	S	94.1	Very high	94.4	Very high	31 Å²	31	64 Å²	64	22%	0.217	35%	0.347	C	S	.	.	S	Bend	trans	-81.2	-14	177.5	56.1	0	0	0	0	113.4	R247	R247-S265 WeakPolarHBondContact CD-O 3.35Å; R247-S265 PolarHBondContact NH1-O 3.49Å
266	Q	94.3	Very high	94.2	Very high	68 Å²	68	64.6 Å²	64.6	32%	0.318	36%	0.359	S	S	.	.	S	Bend	trans	-135.3	142.6	179.9	-59.6	-178.4	24.6	0	0	110.4	F264 T268 N269 L270	F264-Q266 VanDerWaalsContact C-N 3.34Å; Q266-T268 PolarHBondContact O-N 3.48Å; Q266-N269 PolarHBondContact O-N 3.39Å; Q266-L270 PolarHBondContact O-N 3.14Å
267	S	94.8	Very high	93.9	Very high	51 Å²	51	60.5 Å²	60.5	36%	0.357	34%	0.343	S	S	.	.	H	α-helix	trans	-65.8	-36.3	-179.9	54.8	0	0	0	0	112.8	N269 L270 I271	S267-N269 VanDerWaalsContact C-N 3.28Å; S267-N269 PolarHBondContact O-N 2.99Å; S267-L270 WeakPolarHBondContact O-CB 3.29Å; S267-L270 PolarHBondContact O-N 2.82Å; S267-L270 VanDerWaalsContact O-N 3.12Å; S267-I271 WeakPolarHBondContact O-CG1 3.4Å; S267-I271 PolarHBondContact O-N 3.41Å
268	T	93.1	Very high	93.6	Very high	71 Å²	71	64.2 Å²	64.2	44%	0.436	37%	0.365	S	S	.	.	H	α-helix	trans	-57.8	-41.7	176.1	47.5	0	0	0	0	111.8	Q266 L270 I271 I272	Q266-T268 PolarHBondContact O-N 3.48Å; T268-L270 VanDerWaalsContact C-N 3.35Å; T268-I271 PolarHBondContact O-N 3.08Å; T268-I272 VanDerWaalsContact O-CG1 3.3Å; T268-I272 WeakPolarHBondContact O-CG1 3.39Å; T268-I272 PolarHBondContact O-N 3.43Å
269	N	94.3	Very high	93.3	Very high	63 Å²	63	61.3 Å²	61.3	34%	0.337	35%	0.352	S	S	.	.	H	α-helix	trans	-67.7	-35.9	177.4	-66.1	-13.1	0	0	0	111.9	F264 Q266 S267 H273	F264-N269 HydrophobicContact CB-CB 4.22Å; F264-N269 HydrophobicContact CD1-CB 3.86Å; F264-N269 HydrophobicContact CG-CB 4.29Å; Q266-N269 PolarHBondContact O-N 3.39Å; S267-N269 VanDerWaalsContact C-N 3.28Å; S267-N269 PolarHBondContact O-N 2.99Å; N269-H273 VanDerWaalsContact O-CB 3.23Å; N269-H273 WeakPolarHBondContact O-CB 3.36Å; N269-H273 PolarHBondContact O-N 3.14Å
270	L	95.3	Very high	93.1	Very high	22 Å²	22	61 Å²	61	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-46.5	172.3	172.5	62.4	0	0	0	111	C257 F264 Q266 S267 T268 I272 H273 Q274	C257-L270 HydrophobicContact CB-CD1 3.68Å; F264-L270 HydrophobicContact CB-CB 4.39Å; F264-L270 HydrophobicContact CD2-CB 3.95Å; F264-L270 HydrophobicContact CD2-CD1 3.86Å; F264-L270 HydrophobicContact CE2-CD1 4.03Å; F264-L270 HydrophobicContact CG-CB 4.33Å; Q266-L270 PolarHBondContact O-N 3.14Å; S267-L270 WeakPolarHBondContact O-CB 3.29Å; S267-L270 PolarHBondContact O-N 2.82Å; S267-L270 VanDerWaalsContact O-N 3.12Å; T268-L270 VanDerWaalsContact C-N 3.35Å; L270-I272 PolarHBondContact O-N 3Å; L270-H273 CarbonylContact O-C 3.57Å; L270-H273 WeakPolarHBondContact O-CB 3.49Å; L270-H273 PolarHBondContact O-N 2.79Å; L270-H273 VanDerWaalsContact O-N 3.17Å; L270-Q274 HydrophobicContact CD1-CG 4.17Å; L270-Q274 HydrophobicContact CG-CG 4.5Å; L270-Q274 WeakPolarHBondContact O-CG 3.13Å; L270-Q274 PolarHBondContact O-N 3.13Å
271	I	93.3	Very high	92.9	Very high	95 Å²	95	64 Å²	64	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-44.8	178.9	-66.4	165.6	0	0	0	110.9	S267 T268 H273 Q274 K275	S267-I271 WeakPolarHBondContact O-CG1 3.4Å; S267-I271 PolarHBondContact O-N 3.41Å; T268-I271 PolarHBondContact O-N 3.08Å; I271-H273 VanDerWaalsContact C-N 3.31Å; I271-H273 PolarHBondContact O-N 3.14Å; I271-Q274 PolarHBondContact O-N 3.44Å; I271-K275 PolarHBondContact O-N 2.93Å
272	I	92.3	Very high	92.8	Very high	51 Å²	51	65.3 Å²	65.3	26%	0.262	36%	0.357	S	S	.	.	H	α-helix	trans	-61.9	-42.9	176.1	-68.7	165.5	0	0	0	110.3	T268 L270 Q274 K275 E294	T268-I272 VanDerWaalsContact O-CG1 3.3Å; T268-I272 WeakPolarHBondContact O-CG1 3.39Å; T268-I272 PolarHBondContact O-N 3.43Å; L270-I272 PolarHBondContact O-N 3Å; I272-Q274 PolarHBondContact O-N 3.43Å; I272-K275 WeakPolarHBondContact O-CB 3.47Å; I272-K275 PolarHBondContact O-N 3.48Å; I272-E294 HydrophobicContact CG2-CG 3.81Å; I272-E294 WeakPolarHBondContact CG2-OE1 3.24Å
273	H	93.7	Very high	92.7	Very high	23 Å²	23	63.4 Å²	63.4	11%	0.106	35%	0.347	C	S	.	.	H	α-helix	trans	-64	-38.9	177.2	169.6	58.7	0	0	0	112.6	C260 F264 N269 L270 I271 K275 T276 H277	C260-H273 PolarHBondContact SG-NE2 3.19Å; F264-H273 HydrophobicContact CE1-CB 3.95Å; F264-H273 HydrophobicContact CE2-CB 3.9Å; F264-H273 AromaticContact CE2-CD2 3.25Å; F264-H273 WeakPolarHBondContact CE2-CD2 3.23Å; F264-H273 AromaticContact CE2-CG 3.66Å; F264-H273 AromaticContact CE2-NE2 3.99Å; F264-H273 HydrophobicContact CZ-CB 3.42Å; F264-H273 VanDerWaalsContact CZ-CB 3.42Å; F264-H273 AromaticContact CZ-CD2 3.31Å; F264-H273 WeakPolarHBondContact CZ-CD2 3.49Å; F264-H273 AromaticContact CZ-CG 3.23Å; F264-H273 AromaticContact CZ-ND1 3.91Å; F264-H273 AromaticContact CZ-NE2 3.94Å; N269-H273 VanDerWaalsContact O-CB 3.23Å; N269-H273 WeakPolarHBondContact O-CB 3.36Å; N269-H273 PolarHBondContact O-N 3.14Å; L270-H273 CarbonylContact O-C 3.57Å; L270-H273 WeakPolarHBondContact O-CB 3.49Å; L270-H273 PolarHBondContact O-N 2.79Å; L270-H273 VanDerWaalsContact O-N 3.17Å; I271-H273 VanDerWaalsContact C-N 3.31Å; I271-H273 PolarHBondContact O-N 3.14Å; H273-K275 PolarHBondContact O-N 3.43Å; H273-T276 PolarHBondContact ND1-OG1 3.01Å; H273-T276 WeakPolarHBondContact O-CA 3.39Å; H273-T276 VanDerWaalsContact O-CB 3.28Å; H273-T276 WeakPolarHBondContact O-CB 3.27Å; H273-T276 WeakPolarHBondContact O-CG2 3.39Å; H273-T276 PolarHBondContact O-N 3.16Å; H273-T276 PolarHBondContact O-OG1 3.36Å; H273-H277 AromaticContact CE1-NE2 3.46Å; H273-H277 PolarHBondContact CE1-NE2 2.91Å; H273-H277 AromaticContact NE2-NE2 3.24Å; H273-H277 PolarHBondContact NE2-NE2 3.25Å
274	Q	92.9	Very high	92.6	Very high	64 Å²	64	67.1 Å²	67.1	30%	0.299	36%	0.357	S	S	.	.	H	α-helix	trans	-58.1	-32.6	177.3	-77.1	172.9	-44.4	0	0	112.5	L270 I271 I272 T276 H277 T278	L270-Q274 HydrophobicContact CD1-CG 4.17Å; L270-Q274 HydrophobicContact CG-CG 4.5Å; L270-Q274 WeakPolarHBondContact O-CG 3.13Å; L270-Q274 PolarHBondContact O-N 3.13Å; I271-Q274 PolarHBondContact O-N 3.44Å; I272-Q274 PolarHBondContact O-N 3.43Å; Q274-T276 PolarHBondContact O-N 2.78Å; Q274-T276 VanDerWaalsContact O-N 3.11Å; Q274-H277 WeakPolarHBondContact O-CB 3.44Å; Q274-H277 PolarHBondContact O-N 3.5Å; Q274-T278 PolarHBondContact O-N 3.08Å
275	K	93	Very high	92.6	Very high	41 Å²	41	65.1 Å²	65.1	18%	0.178	35%	0.348	C	S	.	.	H	α-helix	trans	-60.2	-22.3	173.1	-60.9	178	177.2	-179	0	113.7	I271 I272 H273 H277 T278 G279 E280 S293	I271-K275 PolarHBondContact O-N 2.93Å; I272-K275 WeakPolarHBondContact O-CB 3.47Å; I272-K275 PolarHBondContact O-N 3.48Å; H273-K275 PolarHBondContact O-N 3.43Å; K275-H277 VanDerWaalsContact C-N 3.29Å; K275-T278 WeakPolarHBondContact CA-OG1 3.39Å; K275-G279 WeakPolarHBondContact O-CA 3.43Å; K275-G279 PolarHBondContact O-N 3.28Å; K275-E280 HydrophobicContact CB-CB 4.47Å; K275-E280 HydrophobicContact CG-CB 4.49Å; K275-E280 PolarHBondContact O-N 3.18Å; K275-S293 PolarHBondContact NZ-O 2.74Å
276	T	91.2	Very high	92.6	Very high	89 Å²	89	70.3 Å²	70.3	55%	0.546	37%	0.374	S	S	.	.	H	α-helix	trans	-73.2	-23.7	175.7	70.2	0	0	0	0	112.7	H273 Q274	H273-T276 PolarHBondContact ND1-OG1 3.01Å; H273-T276 WeakPolarHBondContact O-CA 3.39Å; H273-T276 VanDerWaalsContact O-CB 3.28Å; H273-T276 WeakPolarHBondContact O-CB 3.27Å; H273-T276 WeakPolarHBondContact O-CG2 3.39Å; H273-T276 PolarHBondContact O-N 3.16Å; H273-T276 PolarHBondContact O-OG1 3.36Å; Q274-T276 PolarHBondContact O-N 2.78Å; Q274-T276 VanDerWaalsContact O-N 3.11Å
277	H	90.8	Very high	92.5	Very high	70 Å²	70	72.8 Å²	72.8	32%	0.324	39%	0.385	S	S	.	.	H	α-helix	trans	-84.8	-44.8	174.3	-63.4	-60.1	0	0	0	112	C257 E259 C260 H273 Q274 K275 G279	C257-H277 PolarHBondContact SG-NE2 2.99Å; E259-H277 WeakPolarHBondContact OE2-CB 3.45Å; E259-H277 IonicContact OE2-CD2 3.04Å; E259-H277 IonicContact OE2-CG 3.91Å; E259-H277 IonicContact OE2-ND1 3.05Å; C260-H277 PolarHBondContact SG-NE2 2.86Å; C260-H277 VanDerWaalsContact SG-NE2 3.35Å; H273-H277 AromaticContact CE1-NE2 3.46Å; H273-H277 PolarHBondContact CE1-NE2 2.91Å; H273-H277 AromaticContact NE2-NE2 3.24Å; H273-H277 PolarHBondContact NE2-NE2 3.25Å; Q274-H277 WeakPolarHBondContact O-CB 3.44Å; Q274-H277 PolarHBondContact O-N 3.5Å; K275-H277 VanDerWaalsContact C-N 3.29Å; H277-G279 PolarHBondContact O-N 3.49Å
278	T	89.9	Confident	92.4	Very high	80 Å²	80	72.9 Å²	72.9	49%	0.491	39%	0.385	S	S	.	.	H	α-helix	trans	-73.2	-17.7	179.4	64.1	0	0	0	0	112.9	Q274 K275 E280	Q274-T278 PolarHBondContact O-N 3.08Å; K275-T278 WeakPolarHBondContact CA-OG1 3.39Å; T278-E280 PolarHBondContact O-N 2.91Å; T278-E280 WeakPolarHBondContact OG1-CB 3.35Å; T278-E280 WeakPolarHBondContact OG1-CG 3.26Å; T278-E280 PolarHBondContact OG1-N 3.37Å
279	G	87.8	Confident	92.4	Very high	48 Å²	48	71 Å²	71	50%	0.495	38%	0.38	S	S	.	.			trans	71.1	8.8	-173.8	0	0	0	0	0	113.5	K275 H277 K281	K275-G279 WeakPolarHBondContact O-CA 3.43Å; K275-G279 PolarHBondContact O-N 3.28Å; H277-G279 PolarHBondContact O-N 3.49Å; G279-K281 PolarHBondContact O-N 3.46Å
280	E	89.8	Confident	92.3	Very high	108 Å²	108	73.9 Å²	73.9	51%	0.505	39%	0.39	S	S	.	.			trans	-60.4	118.5	179	-79.8	-179.6	-161.8	0	0	111.2	K275 T278	K275-E280 HydrophobicContact CB-CB 4.47Å; K275-E280 HydrophobicContact CG-CB 4.49Å; K275-E280 PolarHBondContact O-N 3.18Å; T278-E280 PolarHBondContact O-N 2.91Å; T278-E280 WeakPolarHBondContact OG1-CB 3.35Å; T278-E280 WeakPolarHBondContact OG1-CG 3.26Å; T278-E280 PolarHBondContact OG1-N 3.37Å
281	K	90.5	Very high	92.2	Very high	119 Å²	119	78.2 Å²	78.2	52%	0.517	41%	0.408	S	S	.	.			trans	-126.7	78.1	175.4	-65.3	175	-178.8	179.8	0	110.2	G279 Y283 F291 F292	G279-K281 PolarHBondContact O-N 3.46Å; K281-Y283 PolarHBondContact O-N 2.84Å; K281-Y283 VanDerWaalsContact O-N 3.17Å; K281-F291 HydrophobicContact CB-CB 3.58Å; K281-F291 HydrophobicContact CD-CB 4.06Å; K281-F291 HydrophobicContact CG-CB 4.47Å; K281-F291 WeakPolarHBondContact O-CD1 3.46Å; K281-F292 CarbonylContact C-O 3.26Å; K281-F292 VanDerWaalsContact CA-O 3.23Å; K281-F292 WeakPolarHBondContact CA-O 3.39Å
282	P	91.3	Very high	92.1	Very high	81 Å²	81	75.6 Å²	75.6	53%	0.526	39%	0.393	S	S	.	.			trans	-66.8	-18.7	-172.4	-20.9	33.8	0	0	0	114
283	Y	93.6	Very high	92	Very high	85 Å²	85	74.7 Å²	74.7	33%	0.333	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	103.8	-169.9	-56.8	-74.9	0	0	0	110.5	K281 F291 F292 S293	K281-Y283 PolarHBondContact O-N 2.84Å; K281-Y283 VanDerWaalsContact O-N 3.17Å; Y283-F291 CarbonylContact O-C 3.55Å; Y283-F291 WeakPolarHBondContact O-CA 3.42Å; Y283-F292 WeakPolarHBondContact CB-O 3.36Å; Y283-F292 WeakPolarHBondContact CD2-O 3.18Å; Y283-F292 PolarHBondContact N-O 3.49Å; Y283-F292 VanDerWaalsContact N-O 3.12Å; Y283-F292 PolarHBondContact O-N 3.14Å; Y283-S293 WeakPolarHBondContact CE2-O 3.29Å
284	K	94.3	Very high	91.9	Very high	107 Å²	107	77 Å²	77	47%	0.465	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	135.8	177.5	-171.5	-176.2	177.4	-173.9	0	111.2	K290 F291	K284-K290 CarbonylContact C-O 3.23Å; K284-F291 HydrophobicContact CB-CD1 3.82Å; K284-F291 HydrophobicContact CB-CE1 3.66Å; K284-F291 HydrophobicContact CB-CZ 4.28Å; K284-F291 HydrophobicContact CD-CE1 3.92Å; K284-F291 HydrophobicContact CD-CE2 4.45Å; K284-F291 HydrophobicContact CD-CZ 3.74Å; K284-F291 HydrophobicContact CG-CD1 4.12Å; K284-F291 HydrophobicContact CG-CE1 3.74Å; K284-F291 HydrophobicContact CG-CE2 4.27Å; K284-F291 HydrophobicContact CG-CZ 3.82Å
285	C	95.3	Very high	91.9	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	41%	0.407	C	S	.	.			trans	-82.3	123.2	163.5	177.6	0	0	0	0	109.1	E287 G289 K290 F292 L298	C285-E287 VanDerWaalsContact C-N 3.34Å; C285-G289 WeakPolarHBondContact O-CA 3.16Å; C285-G289 PolarHBondContact O-N 2.84Å; C285-K290 WeakPolarHBondContact CB-O 3.49Å; C285-K290 PolarHBondContact N-O 3.27Å; C285-F292 HydrophobicContact CB-CE2 4.26Å; C285-L298 HydrophobicContact CB-CD1 3.68Å
286	N	92.9	Very high	91.9	Very high	141 Å²	141	77.7 Å²	77.7	75%	0.754	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.7	-177.9	-68.2	-25.5	0	0	0	112.9
287	E	92.3	Very high	91.9	Very high	120 Å²	120	74.2 Å²	74.2	56%	0.561	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-39.7	-178.2	-65.3	170.7	155.5	0	0	112.4	C285 H305	C285-E287 VanDerWaalsContact C-N 3.34Å; E287-H305 WeakPolarHBondContact OE2-CB 3.44Å; E287-H305 IonicContact OE2-CD2 3.87Å; E287-H305 PolarHBondContact OE2-CD2 3.5Å; E287-H305 IonicContact OE2-CG 3.03Å; E287-H305 IonicContact OE2-ND1 3.98Å; E287-H305 IonicContact OE2-NE2 2.87Å
288	C	93.9	Very high	92.1	Very high	52 Å²	52	72 Å²	72	35%	0.351	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	2.6	-178.9	71.6	0	0	0	0	115.1	K290 H301 H305	C288-K290 PolarHBondContact O-N 3.02Å; C288-K290 VanDerWaalsContact O-N 3.15Å; C288-K290 VanDerWaalsContact SG-CG 3.56Å; C288-H301 PolarHBondContact SG-NE2 2.9Å; C288-H305 PolarHBondContact SG-NE2 2.83Å; C288-H305 VanDerWaalsContact SG-NE2 3.37Å
289	G	91.3	Very high	92.1	Very high	32 Å²	32	73.8 Å²	73.8	33%	0.33	40%	0.395	S	S	.	.			trans	71.9	1.3	178.6	0	0	0	0	0	115.5	C285 F291	C285-G289 WeakPolarHBondContact O-CA 3.16Å; C285-G289 PolarHBondContact O-N 2.84Å; G289-F291 WeakPolarHBondContact O-CD2 3.38Å; G289-F291 VanDerWaalsContact O-CE2 3.29Å; G289-F291 WeakPolarHBondContact O-CE2 3.39Å
290	K	92.3	Very high	92.3	Very high	124 Å²	124	77.9 Å²	77.9	54%	0.539	40%	0.395	S	S	.	.			trans	-69.4	141.3	-179.3	-72.2	179.2	-177.7	174.3	0	111.9	K284 C285 C288 F292	K284-K290 CarbonylContact C-O 3.23Å; C285-K290 WeakPolarHBondContact CB-O 3.49Å; C285-K290 PolarHBondContact N-O 3.27Å; C288-K290 PolarHBondContact O-N 3.02Å; C288-K290 VanDerWaalsContact O-N 3.15Å; C288-K290 VanDerWaalsContact SG-CG 3.56Å; K290-F292 HydrophobicContact CB-CE2 3.81Å; K290-F292 HydrophobicContact CB-CZ 4.1Å
291	F	93.3	Very high	92.5	Very high	112 Å²	112	73.5 Å²	73.5	49%	0.491	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145.7	178.9	-66.9	-97.5	0	0	0	112.1	K281 Y283 K284 G289	K281-F291 HydrophobicContact CB-CB 3.58Å; K281-F291 HydrophobicContact CD-CB 4.06Å; K281-F291 HydrophobicContact CG-CB 4.47Å; K281-F291 WeakPolarHBondContact O-CD1 3.46Å; Y283-F291 CarbonylContact O-C 3.55Å; Y283-F291 WeakPolarHBondContact O-CA 3.42Å; K284-F291 HydrophobicContact CB-CD1 3.82Å; K284-F291 HydrophobicContact CB-CE1 3.66Å; K284-F291 HydrophobicContact CB-CZ 4.28Å; K284-F291 HydrophobicContact CD-CE1 3.92Å; K284-F291 HydrophobicContact CD-CE2 4.45Å; K284-F291 HydrophobicContact CD-CZ 3.74Å; K284-F291 HydrophobicContact CG-CD1 4.12Å; K284-F291 HydrophobicContact CG-CE1 3.74Å; K284-F291 HydrophobicContact CG-CE2 4.27Å; K284-F291 HydrophobicContact CG-CZ 3.82Å; G289-F291 WeakPolarHBondContact O-CD2 3.38Å; G289-F291 VanDerWaalsContact O-CE2 3.29Å; G289-F291 WeakPolarHBondContact O-CE2 3.39Å
292	F	91.7	Very high	92.5	Very high	41 Å²	41	70.9 Å²	70.9	18%	0.18	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	147.4	-178.5	-59.4	-94.3	0	0	0	110.9	K281 Y283 C285 K290 A297 L298 H301	K281-F292 CarbonylContact C-O 3.26Å; K281-F292 VanDerWaalsContact CA-O 3.23Å; K281-F292 WeakPolarHBondContact CA-O 3.39Å; Y283-F292 WeakPolarHBondContact CB-O 3.36Å; Y283-F292 WeakPolarHBondContact CD2-O 3.18Å; Y283-F292 PolarHBondContact N-O 3.49Å; Y283-F292 VanDerWaalsContact N-O 3.12Å; Y283-F292 PolarHBondContact O-N 3.14Å; C285-F292 HydrophobicContact CB-CE2 4.26Å; K290-F292 HydrophobicContact CB-CE2 3.81Å; K290-F292 HydrophobicContact CB-CZ 4.1Å; F292-A297 HydrophobicContact CB-CB 4.3Å; F292-A297 HydrophobicContact CD1-CB 3.9Å; F292-A297 HydrophobicContact CG-CB 4.44Å; F292-L298 HydrophobicContact CB-CB 4.36Å; F292-L298 HydrophobicContact CD2-CB 4.15Å; F292-L298 HydrophobicContact CD2-CD1 3.5Å; F292-L298 HydrophobicContact CD2-CG 4.47Å; F292-L298 HydrophobicContact CE2-CD1 3.75Å; F292-L298 HydrophobicContact CG-CB 4.33Å; F292-L298 HydrophobicContact CG-CD1 4.46Å; F292-H301 HydrophobicContact CE1-CB 3.89Å; F292-H301 HydrophobicContact CE2-CB 4.06Å; F292-H301 AromaticContact CE2-CD2 3.47Å; F292-H301 VanDerWaalsContact CE2-CD2 3.47Å; F292-H301 WeakPolarHBondContact CE2-CD2 3.46Å; F292-H301 AromaticContact CE2-CG 3.8Å; F292-H301 HydrophobicContact CZ-CB 3.48Å; F292-H301 VanDerWaalsContact CZ-CB 3.48Å; F292-H301 AromaticContact CZ-CD2 3.34Å; F292-H301 WeakPolarHBondContact CZ-CD2 3.47Å; F292-H301 AromaticContact CZ-CG 3.22Å; F292-H301 AromaticContact CZ-ND1 3.77Å; F292-H301 AromaticContact CZ-NE2 3.89Å
293	S	90.4	Very high	92.5	Very high	31 Å²	31	68.4 Å²	68.4	22%	0.217	35%	0.346	C	S	.	.	S	Bend	trans	-78.9	-20	177.5	50.6	0	0	0	0	113.4	K275 Y283	K275-S293 PolarHBondContact NZ-O 2.74Å; Y283-S293 WeakPolarHBondContact CE2-O 3.29Å
294	E	92.4	Very high	92.3	Very high	71 Å²	71	69.5 Å²	69.5	33%	0.332	36%	0.357	S	S	.	.	S	Bend	trans	-131.6	142.1	-177.3	-64.9	177.9	-114	0	0	111.5	I272 S296 A297 L298	I272-E294 HydrophobicContact CG2-CG 3.81Å; I272-E294 WeakPolarHBondContact CG2-OE1 3.24Å; E294-S296 VanDerWaalsContact C-N 3.34Å; E294-S296 PolarHBondContact O-N 2.91Å; E294-A297 HydrophobicContact CB-CB 4.28Å; E294-A297 PolarHBondContact O-N 2.95Å; E294-L298 PolarHBondContact O-N 3.48Å
295	S	92.9	Very high	92.2	Very high	58 Å²	58	68 Å²	68	41%	0.406	35%	0.352	S	S	.	.	H	α-helix	trans	-65.9	-35.6	177.3	57.8	0	0	0	0	112.6	A297 L298 I299	S295-A297 VanDerWaalsContact C-N 3.28Å; S295-A297 PolarHBondContact O-N 2.97Å; S295-L298 WeakPolarHBondContact O-CB 3.48Å; S295-L298 PolarHBondContact O-N 3.5Å; S295-L298 VanDerWaalsContact O-N 3.16Å; S295-I299 WeakPolarHBondContact O-CG1 3.42Å; S295-I299 PolarHBondContact O-N 2.92Å
296	S	91.4	Very high	91.9	Very high	63 Å²	63	71.6 Å²	71.6	44%	0.441	37%	0.374	S	S	.	.	H	α-helix	trans	-60.4	-38.6	175.8	58.4	0	0	0	0	112	E294 R300	E294-S296 VanDerWaalsContact C-N 3.34Å; E294-S296 PolarHBondContact O-N 2.91Å; S296-R300 WeakPolarHBondContact O-CB 3.35Å; S296-R300 PolarHBondContact O-N 3.14Å
297	A	92	Very high	91.6	Very high	15 Å²	15	67.3 Å²	67.3	12%	0.124	36%	0.363	C	S	.	.	H	α-helix	trans	-67.9	-39.6	175.8	0	0	0	0	0	111.4	F292 E294 S295 H301	F292-A297 HydrophobicContact CB-CB 4.3Å; F292-A297 HydrophobicContact CD1-CB 3.9Å; F292-A297 HydrophobicContact CG-CB 4.44Å; E294-A297 HydrophobicContact CB-CB 4.28Å; E294-A297 PolarHBondContact O-N 2.95Å; S295-A297 VanDerWaalsContact C-N 3.28Å; S295-A297 PolarHBondContact O-N 2.97Å; A297-H301 VanDerWaalsContact O-CB 3.3Å; A297-H301 WeakPolarHBondContact O-CB 3.39Å; A297-H301 PolarHBondContact O-N 3.37Å
298	L	94.1	Very high	91.5	Very high	25 Å²	25	67.2 Å²	67.2	13%	0.131	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-47.2	173.7	-179.3	67.7	0	0	0	111.8	C285 F292 E294 S295 R300 H301 H302	C285-L298 HydrophobicContact CB-CD1 3.68Å; F292-L298 HydrophobicContact CB-CB 4.36Å; F292-L298 HydrophobicContact CD2-CB 4.15Å; F292-L298 HydrophobicContact CD2-CD1 3.5Å; F292-L298 HydrophobicContact CD2-CG 4.47Å; F292-L298 HydrophobicContact CE2-CD1 3.75Å; F292-L298 HydrophobicContact CG-CB 4.33Å; F292-L298 HydrophobicContact CG-CD1 4.46Å; E294-L298 PolarHBondContact O-N 3.48Å; S295-L298 WeakPolarHBondContact O-CB 3.48Å; S295-L298 PolarHBondContact O-N 3.5Å; S295-L298 VanDerWaalsContact O-N 3.16Å; L298-R300 PolarHBondContact O-N 3.27Å; L298-H301 WeakPolarHBondContact O-CA 3.38Å; L298-H301 WeakPolarHBondContact O-CB 3.24Å; L298-H301 PolarHBondContact O-N 2.89Å; L298-H301 VanDerWaalsContact O-N 3.09Å; L298-H302 VanDerWaalsContact CD1-CE1 3.43Å; L298-H302 WeakPolarHBondContact CD1-CE1 3.47Å; L298-H302 PolarHBondContact O-N 3.39Å; L298-H302 PolarHBondContact O-ND1 3.34Å
299	I	91.4	Very high	91.4	Very high	116 Å²	116	70.9 Å²	70.9	60%	0.595	37%	0.372	S	S	*	.	H	α-helix	trans	-59.9	-47.8	178.4	-68.4	164.6	0	0	0	110	S295 H301 H302	S295-I299 WeakPolarHBondContact O-CG1 3.42Å; S295-I299 PolarHBondContact O-N 2.92Å; I299-H301 PolarHBondContact O-N 3.24Å; I299-H302 PolarHBondContact O-N 3.04Å; I299-H302 VanDerWaalsContact O-N 3.15Å
300	R	91.4	Very high	91.4	Very high	134 Å²	134	73 Å²	73	51%	0.506	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-34.4	175.6	-179.8	174.6	60.2	-152.9	-4.5	112.3	S296 L298 I303	S296-R300 WeakPolarHBondContact O-CB 3.35Å; S296-R300 PolarHBondContact O-N 3.14Å; L298-R300 PolarHBondContact O-N 3.27Å; R300-I303 WeakPolarHBondContact O-CB 3.31Å
301	H	93	Very high	91.4	Very high	17 Å²	17	71.5 Å²	71.5	8%	0.079	37%	0.372	C	S	.	.	H	α-helix	trans	-69	-37.6	176.5	175.7	62.9	0	0	0	112.6	C288 F292 A297 L298 I299 I303 I304 H305	C288-H301 PolarHBondContact SG-NE2 2.9Å; F292-H301 HydrophobicContact CE1-CB 3.89Å; F292-H301 HydrophobicContact CE2-CB 4.06Å; F292-H301 AromaticContact CE2-CD2 3.47Å; F292-H301 VanDerWaalsContact CE2-CD2 3.47Å; F292-H301 WeakPolarHBondContact CE2-CD2 3.46Å; F292-H301 AromaticContact CE2-CG 3.8Å; F292-H301 HydrophobicContact CZ-CB 3.48Å; F292-H301 VanDerWaalsContact CZ-CB 3.48Å; F292-H301 AromaticContact CZ-CD2 3.34Å; F292-H301 WeakPolarHBondContact CZ-CD2 3.47Å; F292-H301 AromaticContact CZ-CG 3.22Å; F292-H301 AromaticContact CZ-ND1 3.77Å; F292-H301 AromaticContact CZ-NE2 3.89Å; A297-H301 VanDerWaalsContact O-CB 3.3Å; A297-H301 WeakPolarHBondContact O-CB 3.39Å; A297-H301 PolarHBondContact O-N 3.37Å; L298-H301 WeakPolarHBondContact O-CA 3.38Å; L298-H301 WeakPolarHBondContact O-CB 3.24Å; L298-H301 PolarHBondContact O-N 2.89Å; L298-H301 VanDerWaalsContact O-N 3.09Å; I299-H301 PolarHBondContact O-N 3.24Å; H301-I303 PolarHBondContact O-N 2.84Å; H301-I304 VanDerWaalsContact O-CB 3.24Å; H301-I304 WeakPolarHBondContact O-CB 3.44Å; H301-I304 WeakPolarHBondContact O-CG1 3Å; H301-I304 PolarHBondContact O-N 3.25Å; H301-H305 AromaticContact CD2-NE2 3.98Å; H301-H305 AromaticContact CE1-NE2 3.73Å; H301-H305 AromaticContact NE2-CD2 3.97Å; H301-H305 AromaticContact NE2-NE2 3.25Å; H301-H305 PolarHBondContact NE2-NE2 3.15Å
302	H	91.4	Very high	91.5	Very high	63 Å²	63	71.7 Å²	71.7	29%	0.292	37%	0.374	S	S	.	.	H	α-helix	trans	-59.1	-30.3	177.7	-80.3	61.7	0	0	0	112.7	L298 I299 I304 H305 T306	L298-H302 VanDerWaalsContact CD1-CE1 3.43Å; L298-H302 WeakPolarHBondContact CD1-CE1 3.47Å; L298-H302 PolarHBondContact O-N 3.39Å; L298-H302 PolarHBondContact O-ND1 3.34Å; I299-H302 PolarHBondContact O-N 3.04Å; I299-H302 VanDerWaalsContact O-N 3.15Å; H302-I304 PolarHBondContact O-N 3.49Å; H302-I304 VanDerWaalsContact O-N 3.09Å; H302-H305 PolarHBondContact O-N 3.43Å; H302-T306 PolarHBondContact O-N 3.12Å; H302-T306 PolarHBondContact O-OG1 3.38Å
303	I	91.3	Very high	91.7	Very high	29 Å²	29	69.7 Å²	69.7	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-56.8	-27.8	174.8	-57.9	176.4	0	0	0	111.8	R300 H301 H305 T306 G307 E308 N321	R300-I303 WeakPolarHBondContact O-CB 3.31Å; H301-I303 PolarHBondContact O-N 2.84Å; I303-H305 VanDerWaalsContact C-N 3.35Å; I303-T306 WeakPolarHBondContact CA-OG1 3.32Å; I303-T306 PolarHBondContact O-OG1 3.02Å; I303-G307 PolarHBondContact O-N 3.16Å; I303-E308 HydrophobicContact CG2-CB 4.24Å; I303-E308 WeakPolarHBondContact CG2-O 2.93Å; I303-N321 HydrophobicContact CG2-CB 3.8Å
304	I	90.1	Very high	91.8	Very high	109 Å²	109	75.7 Å²	75.7	56%	0.559	40%	0.395	S	S	*	.	H	α-helix	trans	-69.2	-36.4	177.3	-56.8	178.2	0	0	0	111	H301 H302	H301-I304 VanDerWaalsContact O-CB 3.24Å; H301-I304 WeakPolarHBondContact O-CB 3.44Å; H301-I304 WeakPolarHBondContact O-CG1 3Å; H301-I304 PolarHBondContact O-N 3.25Å; H302-I304 PolarHBondContact O-N 3.49Å; H302-I304 VanDerWaalsContact O-N 3.09Å
305	H	90.6	Very high	91.8	Very high	75 Å²	75	78.3 Å²	78.3	35%	0.347	41%	0.407	S	S	.	.	H	α-helix	trans	-78.9	-41	-179.3	-67.1	-58.5	0	0	0	112	E287 C288 H301 H302 I303 G307	E287-H305 WeakPolarHBondContact OE2-CB 3.44Å; E287-H305 IonicContact OE2-CD2 3.87Å; E287-H305 PolarHBondContact OE2-CD2 3.5Å; E287-H305 IonicContact OE2-CG 3.03Å; E287-H305 IonicContact OE2-ND1 3.98Å; E287-H305 IonicContact OE2-NE2 2.87Å; C288-H305 PolarHBondContact SG-NE2 2.83Å; C288-H305 VanDerWaalsContact SG-NE2 3.37Å; H301-H305 AromaticContact CD2-NE2 3.98Å; H301-H305 AromaticContact CE1-NE2 3.73Å; H301-H305 AromaticContact NE2-CD2 3.97Å; H301-H305 AromaticContact NE2-NE2 3.25Å; H301-H305 PolarHBondContact NE2-NE2 3.15Å; H302-H305 PolarHBondContact O-N 3.43Å; I303-H305 VanDerWaalsContact C-N 3.35Å; H305-G307 PolarHBondContact O-N 3.36Å
306	T	89.8	Confident	91.8	Very high	76 Å²	76	78.1 Å²	78.1	47%	0.466	41%	0.405	S	S	.	.	H	α-helix	trans	-72	-19.4	176.2	60.2	0	0	0	0	112.4	H302 I303 E308	H302-T306 PolarHBondContact O-N 3.12Å; H302-T306 PolarHBondContact O-OG1 3.38Å; I303-T306 WeakPolarHBondContact CA-OG1 3.32Å; I303-T306 PolarHBondContact O-OG1 3.02Å; T306-E308 PolarHBondContact O-N 2.81Å
307	G	87.4	Confident	91.8	Very high	51 Å²	51	77.1 Å²	77.1	53%	0.526	41%	0.405	S	S	.	.			trans	68.8	6.6	-175.7	0	0	0	0	0	113.4	I303 H305	I303-G307 PolarHBondContact O-N 3.16Å; H305-G307 PolarHBondContact O-N 3.36Å
308	E	90.2	Very high	91.9	Very high	118 Å²	118	82.3 Å²	82.3	55%	0.551	43%	0.425	S	S	*	.			trans	-59.6	140.5	178.7	-73.9	-179.7	-177.4	0	0	110.5	I303 T306 P310	I303-E308 HydrophobicContact CG2-CB 4.24Å; I303-E308 WeakPolarHBondContact CG2-O 2.93Å; T306-E308 PolarHBondContact O-N 2.81Å; E308-P310 HydrophobicContact CB-CG 4.49Å
309	K	90.6	Very high	91.9	Very high	129 Å²	129	82.8 Å²	82.8	56%	0.561	43%	0.432	S	S	*	.			trans	-127.4	77	175.5	-69.7	173.2	176.1	-179	0	109	Y311 A319 F320	K309-Y311 PolarHBondContact O-N 3.33Å; K309-A319 HydrophobicContact CB-CB 3.5Å; K309-A319 HydrophobicContact CD-CB 4.07Å; K309-A319 WeakPolarHBondContact CD-O 3.28Å; K309-A319 HydrophobicContact CG-CB 4.42Å; K309-F320 CarbonylContact C-O 3.57Å; K309-F320 VanDerWaalsContact C-O 3.26Å; K309-F320 VanDerWaalsContact CA-O 3.31Å; K309-F320 WeakPolarHBondContact CA-O 3.48Å
310	P	91.4	Very high	91.9	Very high	76 Å²	76	79.4 Å²	79.4	49%	0.494	41%	0.413	S	S	.	.			trans	-66.3	-12.8	-170.3	-21.5	34.2	0	0	0	114.3	E308	E308-P310 HydrophobicContact CB-CG 4.49Å
311	Y	93.8	Very high	91.9	Very high	93 Å²	93	75.9 Å²	75.9	37%	0.365	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	94.3	-172.1	-56.5	-78.5	0	0	0	110.4	K309 A319 F320 Q322	K309-Y311 PolarHBondContact O-N 3.33Å; Y311-A319 CarbonylContact O-C 3.25Å; Y311-A319 WeakPolarHBondContact O-CA 3.41Å; Y311-F320 PolarHBondContact N-O 3.43Å; Y311-F320 VanDerWaalsContact N-O 3.17Å; Y311-F320 PolarHBondContact O-N 2.92Å; Y311-Q322 VanDerWaalsContact CD2-C 3.44Å
312	E	94.4	Very high	91.8	Very high	115 Å²	115	78.3 Å²	78.3	54%	0.537	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	141.5	179.5	-167.1	176.4	163.6	0	0	112.6	A319 L326	E312-A319 HydrophobicContact CB-CB 4.48Å; E312-A319 HydrophobicContact CG-CB 4.49Å; E312-L326 WeakPolarHBondContact O-CD2 3.46Å
313	C	95.1	Very high	91.8	Very high	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.423	C	S	.	.			trans	-85.9	112.2	171.7	-178.6	0	0	0	0	110.5	E315 C316 G317 K318 L326 H333	C313-E315 PolarHBondContact O-N 3.36Å; C313-E315 VanDerWaalsContact O-N 3.12Å; C313-C316 PolarHBondContact O-N 3.31Å; C313-C316 VanDerWaalsContact SG-SG 3.67Å; C313-G317 VanDerWaalsContact O-CA 3.31Å; C313-G317 WeakPolarHBondContact O-CA 3.41Å; C313-G317 PolarHBondContact O-N 1.99Å; C313-K318 WeakPolarHBondContact CB-O 3.36Å; C313-K318 PolarHBondContact N-O 3.09Å; C313-L326 HydrophobicContact CB-CD1 3.62Å; C313-H333 PolarHBondContact SG-NE2 2.95Å; C313-H333 VanDerWaalsContact SG-NE2 3.36Å
314	N	93.3	Very high	91.8	Very high	157 Å²	157	80 Å²	80	84%	0.84	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.7	179.8	-61.8	-18.2	0	0	0	114.3
315	E	92.1	Very high	91.9	Very high	126 Å²	126	76.5 Å²	76.5	59%	0.589	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-27	-178.3	-67.7	173.8	148.3	0	0	113.1	C313 H333	C313-E315 PolarHBondContact O-N 3.36Å; C313-E315 VanDerWaalsContact O-N 3.12Å; E315-H333 WeakPolarHBondContact OE2-CB 3.38Å; E315-H333 IonicContact OE2-CD2 3.66Å; E315-H333 PolarHBondContact OE2-CD2 3.32Å; E315-H333 IonicContact OE2-CG 3.95Å; E315-H333 IonicContact OE2-NE2 3.21Å
316	C	94.1	Very high	92.1	Very high	53 Å²	53	73.9 Å²	73.9	36%	0.358	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	5.3	-175	75.7	0	0	0	0	115.2	C313 K318 H329 H333	C313-C316 PolarHBondContact O-N 3.31Å; C313-C316 VanDerWaalsContact SG-SG 3.67Å; C316-K318 PolarHBondContact O-N 3.13Å; C316-K318 VanDerWaalsContact O-N 3.11Å; C316-H329 PolarHBondContact SG-NE2 2.75Å; C316-H333 PolarHBondContact SG-NE2 3.29Å
317	G	91.3	Very high	92.2	Very high	42 Å²	42	73 Å²	73	43%	0.433	41%	0.408	S	S	.	.			trans	68.6	2.7	179.8	0	0	0	0	0	115.1	C313 A319	C313-G317 VanDerWaalsContact O-CA 3.31Å; C313-G317 WeakPolarHBondContact O-CA 3.41Å; C313-G317 PolarHBondContact O-N 1.99Å; G317-A319 PolarHBondContact O-N 3.23Å
318	K	93.3	Very high	92.4	Very high	125 Å²	125	74.8 Å²	74.8	54%	0.543	40%	0.402	S	S	.	.			trans	-71.6	124	-179.9	-73.2	-177	-179.5	178.8	0	110.6	C313 C316 F320	C313-K318 WeakPolarHBondContact CB-O 3.36Å; C313-K318 PolarHBondContact N-O 3.09Å; C316-K318 PolarHBondContact O-N 3.13Å; C316-K318 VanDerWaalsContact O-N 3.11Å; K318-F320 HydrophobicContact CB-CE2 3.94Å; K318-F320 HydrophobicContact CB-CZ 4.11Å; K318-F320 VanDerWaalsContact O-CE2 3.31Å; K318-F320 WeakPolarHBondContact O-CE2 3.43Å
319	A	93.8	Very high	92.5	Very high	34 Å²	34	70 Å²	70	28%	0.281	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	145.9	178.9	0	0	0	0	0	112.9	K309 Y311 E312 G317	K309-A319 HydrophobicContact CB-CB 3.5Å; K309-A319 HydrophobicContact CD-CB 4.07Å; K309-A319 WeakPolarHBondContact CD-O 3.28Å; K309-A319 HydrophobicContact CG-CB 4.42Å; Y311-A319 CarbonylContact O-C 3.25Å; Y311-A319 WeakPolarHBondContact O-CA 3.41Å; E312-A319 HydrophobicContact CB-CB 4.48Å; E312-A319 HydrophobicContact CG-CB 4.49Å; G317-A319 PolarHBondContact O-N 3.23Å
320	F	92.6	Very high	92.6	Very high	45 Å²	45	67.5 Å²	67.5	20%	0.197	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154	-177	-58.4	-90.9	0	0	0	111	K309 Y311 K318 L326 H329	K309-F320 CarbonylContact C-O 3.57Å; K309-F320 VanDerWaalsContact C-O 3.26Å; K309-F320 VanDerWaalsContact CA-O 3.31Å; K309-F320 WeakPolarHBondContact CA-O 3.48Å; Y311-F320 PolarHBondContact N-O 3.43Å; Y311-F320 VanDerWaalsContact N-O 3.17Å; Y311-F320 PolarHBondContact O-N 2.92Å; K318-F320 HydrophobicContact CB-CE2 3.94Å; K318-F320 HydrophobicContact CB-CZ 4.11Å; K318-F320 VanDerWaalsContact O-CE2 3.31Å; K318-F320 WeakPolarHBondContact O-CE2 3.43Å; F320-L326 HydrophobicContact CB-CB 4.41Å; F320-L326 HydrophobicContact CD2-CB 3.9Å; F320-L326 HydrophobicContact CD2-CD1 3.84Å; F320-L326 HydrophobicContact CD2-CG 4.48Å; F320-L326 HydrophobicContact CE2-CD1 3.98Å; F320-L326 HydrophobicContact CG-CB 4.35Å; F320-H329 HydrophobicContact CE1-CB 4.05Å; F320-H329 HydrophobicContact CE2-CB 3.73Å; F320-H329 AromaticContact CE2-CD2 3.6Å; F320-H329 AromaticContact CE2-CG 3.58Å; F320-H329 HydrophobicContact CZ-CB 3.38Å; F320-H329 AromaticContact CZ-CD2 3.75Å; F320-H329 AromaticContact CZ-CG 3.27Å; F320-H329 AromaticContact CZ-ND1 3.67Å
321	N	90.8	Very high	92.6	Very high	61 Å²	61	67.3 Å²	67.3	33%	0.326	36%	0.36	S	S	.	.	S	Bend	trans	-84.1	-9.7	176.4	60.7	14.1	0	0	0	113.6	I303	I303-N321 HydrophobicContact CG2-CB 3.8Å
322	Q	90.6	Very high	92.4	Very high	68 Å²	68	66.8 Å²	66.8	32%	0.318	36%	0.363	S	S	.	.	S	Bend	trans	-137.7	140.6	-179.6	-66.4	178.4	31.2	0	0	110.9	Y311 S324 S325 L326	Y311-Q322 VanDerWaalsContact CD2-C 3.44Å; Q322-S324 VanDerWaalsContact C-N 3.3Å; Q322-S324 PolarHBondContact O-N 3.38Å; Q322-S324 PolarHBondContact OE1-OG 3.29Å; Q322-S325 WeakPolarHBondContact O-CB 3.49Å; Q322-S325 PolarHBondContact O-N 3.48Å; Q322-L326 PolarHBondContact O-N 3.14Å
323	S	92.3	Very high	92.3	Very high	62 Å²	62	64.8 Å²	64.8	43%	0.434	35%	0.353	S	S	.	.	H	α-helix	trans	-64.2	-32.7	177.1	58.2	0	0	0	0	113.1	L326 S327	S323-L326 PolarHBondContact O-N 3.1Å; S323-S327 WeakPolarHBondContact O-CB 3.45Å; S323-S327 PolarHBondContact O-N 2.75Å; S323-S327 PolarHBondContact O-OG 3.32Å
324	S	91.1	Very high	92	Very high	66 Å²	66	68.9 Å²	68.9	46%	0.462	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-41.8	174.7	49.2	0	0	0	0	111.7	Q322 S327 Q328	Q322-S324 VanDerWaalsContact C-N 3.3Å; Q322-S324 PolarHBondContact O-N 3.38Å; Q322-S324 PolarHBondContact OE1-OG 3.29Å; S324-S327 PolarHBondContact O-N 3.35Å; S324-Q328 WeakPolarHBondContact O-CB 3.4Å; S324-Q328 PolarHBondContact O-N 2.86Å
325	S	92.5	Very high	91.7	Very high	34 Å²	34	63.4 Å²	63.4	24%	0.238	36%	0.359	C	S	.	.	H	α-helix	trans	-64.8	-42.9	175.9	-56.7	0	0	0	0	111.4	Q322 Q328 H329	Q322-S325 WeakPolarHBondContact O-CB 3.49Å; Q322-S325 PolarHBondContact O-N 3.48Å; S325-Q328 PolarHBondContact O-N 3.24Å; S325-H329 WeakPolarHBondContact O-CB 3.29Å; S325-H329 PolarHBondContact O-N 2.84Å
326	L	94.1	Very high	91.7	Very high	20 Å²	20	61 Å²	61	11%	0.105	35%	0.352	C	S	.	.	H	α-helix	trans	-61.7	-46.9	172.9	174.1	62.2	0	0	0	111.4	E312 C313 F320 Q322 S323 Q328 H329 Q330	E312-L326 WeakPolarHBondContact O-CD2 3.46Å; C313-L326 HydrophobicContact CB-CD1 3.62Å; F320-L326 HydrophobicContact CB-CB 4.41Å; F320-L326 HydrophobicContact CD2-CB 3.9Å; F320-L326 HydrophobicContact CD2-CD1 3.84Å; F320-L326 HydrophobicContact CD2-CG 4.48Å; F320-L326 HydrophobicContact CE2-CD1 3.98Å; F320-L326 HydrophobicContact CG-CB 4.35Å; Q322-L326 PolarHBondContact O-N 3.14Å; S323-L326 PolarHBondContact O-N 3.1Å; L326-Q328 VanDerWaalsContact C-N 3.29Å; L326-Q328 PolarHBondContact O-N 3.48Å; L326-H329 CarbonylContact O-C 3.26Å; L326-H329 WeakPolarHBondContact O-CA 3.33Å; L326-H329 WeakPolarHBondContact O-CB 3.38Å; L326-H329 PolarHBondContact O-N 3.1Å; L326-Q330 HydrophobicContact CD1-CG 4.19Å; L326-Q330 HydrophobicContact CG-CG 4.48Å; L326-Q330 WeakPolarHBondContact O-CG 3.38Å; L326-Q330 PolarHBondContact O-N 3.38Å
327	S	92	Very high	91.5	Very high	58 Å²	58	63.7 Å²	63.7	41%	0.406	36%	0.358	S	S	.	.	H	α-helix	trans	-61.3	-38.5	179.3	-57.4	0	0	0	0	111.9	S323 S324	S323-S327 WeakPolarHBondContact O-CB 3.45Å; S323-S327 PolarHBondContact O-N 2.75Å; S323-S327 PolarHBondContact O-OG 3.32Å; S324-S327 PolarHBondContact O-N 3.35Å
328	Q	91.2	Very high	91.5	Very high	88 Å²	88	64.9 Å²	64.9	41%	0.411	36%	0.358	S	S	.	.	H	α-helix	trans	-67.9	-39.9	173.5	-178.1	-177.7	0.5	0	0	111.4	S324 S325 L326 R331	S324-Q328 WeakPolarHBondContact O-CB 3.4Å; S324-Q328 PolarHBondContact O-N 2.86Å; S325-Q328 PolarHBondContact O-N 3.24Å; L326-Q328 VanDerWaalsContact C-N 3.29Å; L326-Q328 PolarHBondContact O-N 3.48Å; Q328-R331 WeakPolarHBondContact O-CB 3.49Å; Q328-R331 PolarHBondContact O-N 3.1Å
329	H	92.4	Very high	91.4	Very high	18 Å²	18	62.5 Å²	62.5	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-41.9	177	171.3	70.9	0	0	0	112.4	C316 F320 S325 L326 R331 I332 H333	C316-H329 PolarHBondContact SG-NE2 2.75Å; F320-H329 HydrophobicContact CE1-CB 4.05Å; F320-H329 HydrophobicContact CE2-CB 3.73Å; F320-H329 AromaticContact CE2-CD2 3.6Å; F320-H329 AromaticContact CE2-CG 3.58Å; F320-H329 HydrophobicContact CZ-CB 3.38Å; F320-H329 AromaticContact CZ-CD2 3.75Å; F320-H329 AromaticContact CZ-CG 3.27Å; F320-H329 AromaticContact CZ-ND1 3.67Å; S325-H329 WeakPolarHBondContact O-CB 3.29Å; S325-H329 PolarHBondContact O-N 2.84Å; L326-H329 CarbonylContact O-C 3.26Å; L326-H329 WeakPolarHBondContact O-CA 3.33Å; L326-H329 WeakPolarHBondContact O-CB 3.38Å; L326-H329 PolarHBondContact O-N 3.1Å; H329-R331 PolarHBondContact O-N 3.12Å; H329-I332 WeakPolarHBondContact O-CB 3.28Å; H329-I332 VanDerWaalsContact O-CG1 3.23Å; H329-I332 WeakPolarHBondContact O-CG1 3.49Å; H329-I332 PolarHBondContact O-N 3.2Å; H329-H333 AromaticContact CD2-NE2 3.92Å; H329-H333 AromaticContact CE1-NE2 3.79Å; H329-H333 AromaticContact NE2-CD2 3.94Å; H329-H333 AromaticContact NE2-CE1 3.94Å; H329-H333 AromaticContact NE2-NE2 3.12Å; H329-H333 PolarHBondContact NE2-NE2 3.24Å; H329-H333 VanDerWaalsContact NE2-NE2 3.12Å
330	Q	91.9	Very high	91.3	Very high	77 Å²	77	67.3 Å²	67.3	36%	0.36	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-20.5	177.4	-73.8	171.5	-36.1	0	0	113.5	L326 I332 H333 T334	L326-Q330 HydrophobicContact CD1-CG 4.19Å; L326-Q330 HydrophobicContact CG-CG 4.48Å; L326-Q330 WeakPolarHBondContact O-CG 3.38Å; L326-Q330 PolarHBondContact O-N 3.38Å; Q330-I332 PolarHBondContact O-N 3.4Å; Q330-H333 PolarHBondContact O-N 2.83Å; Q330-T334 PolarHBondContact O-N 3.14Å; Q330-T334 VanDerWaalsContact O-N 3.12Å; Q330-T334 PolarHBondContact O-OG1 2.97Å
331	R	92.2	Very high	91.2	Very high	71 Å²	71	65.2 Å²	65.2	27%	0.268	35%	0.354	S	S	.	.	H	α-helix	trans	-66.8	-17.2	172.2	-60.2	177.5	-173.8	-172.3	-5.8	113.5	Q328 H329 T334 G335 V336 R349	Q328-R331 WeakPolarHBondContact O-CB 3.49Å; Q328-R331 PolarHBondContact O-N 3.1Å; H329-R331 PolarHBondContact O-N 3.12Å; R331-T334 WeakPolarHBondContact CA-OG1 3.49Å; R331-G335 WeakPolarHBondContact O-CA 3.45Å; R331-G335 PolarHBondContact O-N 3.39Å; R331-G335 VanDerWaalsContact O-N 3.17Å; R331-V336 PolarHBondContact O-N 2.62Å; R331-R349 WeakPolarHBondContact CD-O 3.48Å; R331-R349 PolarHBondContact NH1-O 3.19Å
332	I	90.6	Very high	91.2	Very high	83 Å²	83	67.7 Å²	67.7	43%	0.426	38%	0.376	S	S	.	.	H	α-helix	trans	-70	-44.9	174.6	-59.4	179	0	0	0	109.5	H329 Q330	H329-I332 WeakPolarHBondContact O-CB 3.28Å; H329-I332 VanDerWaalsContact O-CG1 3.23Å; H329-I332 WeakPolarHBondContact O-CG1 3.49Å; H329-I332 PolarHBondContact O-N 3.2Å; Q330-I332 PolarHBondContact O-N 3.4Å
333	H	90.6	Very high	91.1	Very high	73 Å²	73	71 Å²	71	34%	0.338	39%	0.392	S	S	.	.	H	α-helix	trans	-75.2	-43.9	-177.1	-55.6	-52.6	0	0	0	112.1	C313 E315 C316 H329 Q330 G335	C313-H333 PolarHBondContact SG-NE2 2.95Å; C313-H333 VanDerWaalsContact SG-NE2 3.36Å; E315-H333 WeakPolarHBondContact OE2-CB 3.38Å; E315-H333 IonicContact OE2-CD2 3.66Å; E315-H333 PolarHBondContact OE2-CD2 3.32Å; E315-H333 IonicContact OE2-CG 3.95Å; E315-H333 IonicContact OE2-NE2 3.21Å; C316-H333 PolarHBondContact SG-NE2 3.29Å; H329-H333 AromaticContact CD2-NE2 3.92Å; H329-H333 AromaticContact CE1-NE2 3.79Å; H329-H333 AromaticContact NE2-CD2 3.94Å; H329-H333 AromaticContact NE2-CE1 3.94Å; H329-H333 AromaticContact NE2-NE2 3.12Å; H329-H333 PolarHBondContact NE2-NE2 3.24Å; H329-H333 VanDerWaalsContact NE2-NE2 3.12Å; Q330-H333 PolarHBondContact O-N 2.83Å; H333-G335 PolarHBondContact O-N 2.89Å
334	T	89.5	Confident	91.1	Very high	86 Å²	86	70.6 Å²	70.6	53%	0.528	39%	0.388	S	S	.	.	S	Bend	trans	-75.2	-10.9	177.4	56.3	0	0	0	0	113.6	Q330 R331 V336	Q330-T334 PolarHBondContact O-N 3.14Å; Q330-T334 VanDerWaalsContact O-N 3.12Å; Q330-T334 PolarHBondContact O-OG1 2.97Å; R331-T334 WeakPolarHBondContact CA-OG1 3.49Å; T334-V336 PolarHBondContact O-N 2.96Å
335	G	87.4	Confident	90.9	Very high	42 Å²	42	69.5 Å²	69.5	43%	0.433	39%	0.387	S	S	.	.			trans	67.6	0.3	-177.1	0	0	0	0	0	115.3	R331 H333 K337	R331-G335 WeakPolarHBondContact O-CA 3.45Å; R331-G335 PolarHBondContact O-N 3.39Å; R331-G335 VanDerWaalsContact O-N 3.17Å; H333-G335 PolarHBondContact O-N 2.89Å; G335-K337 PolarHBondContact O-N 3.21Å
336	V	91.6	Very high	90.8	Very high	75 Å²	75	73.8 Å²	73.8	46%	0.455	40%	0.401	S	S	.	.			trans	-63.3	125.5	-175.1	178.6	0	0	0	0	110.8	R331 T334 P338	R331-V336 PolarHBondContact O-N 2.62Å; T334-V336 PolarHBondContact O-N 2.96Å; V336-P338 HydrophobicContact CG1-CG 3.95Å
337	K	90.9	Very high	90.6	Very high	109 Å²	109	74.4 Å²	74.4	47%	0.474	41%	0.409	S	S	.	.			trans	-120.8	86.6	176.3	-70.3	170	172.4	-171.8	0	109.7	G335 Y339 A347 F348 R349	G335-K337 PolarHBondContact O-N 3.21Å; K337-Y339 PolarHBondContact O-N 3.06Å; K337-A347 HydrophobicContact CB-CB 3.67Å; K337-A347 HydrophobicContact CD-CB 3.92Å; K337-A347 WeakPolarHBondContact CD-O 3.29Å; K337-A347 HydrophobicContact CG-CB 4.43Å; K337-F348 CarbonylContact C-O 3.6Å; K337-F348 WeakPolarHBondContact CA-O 3.49Å; K337-R349 HydrophobicContact CG-CG 3.82Å
338	P	89.8	Confident	90.5	Very high	67 Å²	67	73.6 Å²	73.6	44%	0.435	40%	0.399	S	S	.	.			trans	-70.1	-15.2	-170.9	-17.8	30.6	0	0	0	114.9	V336	V336-P338 HydrophobicContact CG1-CG 3.95Å
339	Y	91.1	Very high	90.3	Very high	76 Å²	76	74.5 Å²	74.5	30%	0.298	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	103	-171.2	-54.4	-77.2	0	0	0	109.6	K337 A347 F348 C350 S351 F354	K337-Y339 PolarHBondContact O-N 3.06Å; Y339-A347 CarbonylContact O-C 3.48Å; Y339-A347 VanDerWaalsContact O-CA 3.28Å; Y339-A347 WeakPolarHBondContact O-CA 3.5Å; Y339-F348 PolarHBondContact N-O 3.42Å; Y339-F348 PolarHBondContact O-N 3.23Å; Y339-C350 VanDerWaalsContact CD2-C 3.49Å; Y339-S351 VanDerWaalsContact CE2-N 3.28Å; Y339-F354 HydrophobicContact CD1-CD1 4.49Å; Y339-F354 HydrophobicContact CG-CB 4.34Å
340	E	91.6	Very high	90.1	Very high	134 Å²	134	74.8 Å²	74.8	63%	0.626	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	134.7	-179.9	-169.6	175.3	167.7	0	0	110.8	A347 F354	E340-A347 HydrophobicContact CB-CB 4.44Å; E340-A347 HydrophobicContact CG-CB 4.42Å; E340-F354 WeakPolarHBondContact O-CE2 3.3Å
341	C	92.2	Very high	89.9	Confident	2 Å²	2	74 Å²	74	1%	0.014	41%	0.405	C	S	.	.			trans	-80.2	117.7	174.2	-178.6	0	0	0	0	109.7	E343 G345 K346 F354 H361	C341-E343 PolarHBondContact O-N 3.43Å; C341-G345 WeakPolarHBondContact O-CA 3.48Å; C341-G345 PolarHBondContact O-N 3.03Å; C341-K346 WeakPolarHBondContact CB-O 3.27Å; C341-K346 PolarHBondContact N-O 3.37Å; C341-F354 HydrophobicContact CB-CE2 4.06Å; C341-H361 PolarHBondContact SG-NE2 3.07Å
342	S	89.6	Confident	89.8	Confident	113 Å²	113	74.5 Å²	74.5	79%	0.79	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.4	177.2	48.6	0	0	0	0	113.6
343	E	88.4	Confident	89.8	Confident	138 Å²	138	71.5 Å²	71.5	65%	0.645	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-32.4	-175.7	-65	174.9	-155.7	0	0	113.1	C341 H361	C341-E343 PolarHBondContact O-N 3.43Å; E343-H361 WeakPolarHBondContact OE2-CB 3.41Å; E343-H361 IonicContact OE2-CD2 3.85Å; E343-H361 PolarHBondContact OE2-CD2 2.95Å; E343-H361 IonicContact OE2-CG 3.66Å; E343-H361 IonicContact OE2-ND1 3.06Å
344	C	91.8	Very high	89.8	Confident	52 Å²	52	69.4 Å²	69.4	35%	0.351	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	4	-175.5	76.9	0	0	0	0	114.8	K346 H357	C344-K346 PolarHBondContact O-N 3.26Å; C344-K346 VanDerWaalsContact O-N 3.09Å; C344-K346 VanDerWaalsContact SG-CG 3.57Å; C344-H357 PolarHBondContact SG-NE2 3.1Å
345	G	87.7	Confident	89.8	Confident	43 Å²	43	68.3 Å²	68.3	44%	0.443	39%	0.39	S	S	.	.			trans	68.2	2.4	179.8	0	0	0	0	0	115.2	C341 A347	C341-G345 WeakPolarHBondContact O-CA 3.48Å; C341-G345 PolarHBondContact O-N 3.03Å; G345-A347 PolarHBondContact O-N 3.12Å
346	K	90.3	Very high	90	Very high	124 Å²	124	74.7 Å²	74.7	54%	0.539	40%	0.401	S	S	.	.			trans	-71.1	125.7	-178.8	-72.1	179.1	-176.9	173	0	110.6	C341 C344 F348	C341-K346 WeakPolarHBondContact CB-O 3.27Å; C341-K346 PolarHBondContact N-O 3.37Å; C344-K346 PolarHBondContact O-N 3.26Å; C344-K346 VanDerWaalsContact O-N 3.09Å; C344-K346 VanDerWaalsContact SG-CG 3.57Å; K346-F348 HydrophobicContact CB-CE2 3.73Å; K346-F348 HydrophobicContact CB-CZ 3.93Å; K346-F348 WeakPolarHBondContact O-CD2 3.22Å; K346-F348 VanDerWaalsContact O-CE2 3.25Å; K346-F348 WeakPolarHBondContact O-CE2 3.26Å
347	A	90.5	Very high	89.9	Confident	33 Å²	33	72 Å²	72	27%	0.273	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.9	177.7	0	0	0	0	0	112.8	K337 Y339 E340 G345	K337-A347 HydrophobicContact CB-CB 3.67Å; K337-A347 HydrophobicContact CD-CB 3.92Å; K337-A347 WeakPolarHBondContact CD-O 3.29Å; K337-A347 HydrophobicContact CG-CB 4.43Å; Y339-A347 CarbonylContact O-C 3.48Å; Y339-A347 VanDerWaalsContact O-CA 3.28Å; Y339-A347 WeakPolarHBondContact O-CA 3.5Å; E340-A347 HydrophobicContact CB-CB 4.44Å; E340-A347 HydrophobicContact CG-CB 4.42Å; G345-A347 PolarHBondContact O-N 3.12Å
348	F	89.1	Confident	89.7	Confident	41 Å²	41	70.6 Å²	70.6	18%	0.18	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	148.8	-174	-59.3	-94.2	0	0	0	111.3	K337 Y339 K346 A353 F354 H357	K337-F348 CarbonylContact C-O 3.6Å; K337-F348 WeakPolarHBondContact CA-O 3.49Å; Y339-F348 PolarHBondContact N-O 3.42Å; Y339-F348 PolarHBondContact O-N 3.23Å; K346-F348 HydrophobicContact CB-CE2 3.73Å; K346-F348 HydrophobicContact CB-CZ 3.93Å; K346-F348 WeakPolarHBondContact O-CD2 3.22Å; K346-F348 VanDerWaalsContact O-CE2 3.25Å; K346-F348 WeakPolarHBondContact O-CE2 3.26Å; F348-A353 HydrophobicContact CD1-CB 4.03Å; F348-F354 HydrophobicContact CB-CB 4.06Å; F348-F354 HydrophobicContact CD2-CB 4.15Å; F348-F354 AromaticContact CD2-CD2 3.72Å; F348-F354 HydrophobicContact CD2-CD2 3.72Å; F348-F354 HydrophobicContact CD2-CG 4.44Å; F348-F354 HydrophobicContact CE2-CD2 4.19Å; F348-F354 HydrophobicContact CG-CB 4.18Å; F348-H357 HydrophobicContact CE1-CB 3.85Å; F348-H357 HydrophobicContact CE2-CB 3.88Å; F348-H357 AromaticContact CE2-CD2 3.35Å; F348-H357 WeakPolarHBondContact CE2-CD2 3.42Å; F348-H357 AromaticContact CE2-CG 3.65Å; F348-H357 HydrophobicContact CZ-CB 3.36Å; F348-H357 AromaticContact CZ-CD2 3.38Å; F348-H357 WeakPolarHBondContact CZ-CD2 3.42Å; F348-H357 AromaticContact CZ-CG 3.19Å; F348-H357 AromaticContact CZ-ND1 3.84Å
349	R	87.3	Confident	89.7	Confident	107 Å²	107	74.1 Å²	74.1	40%	0.404	38%	0.383	S	S	.	.	S	Bend	trans	-81.3	-24.5	179.9	-60.2	-178.6	-164.2	150.7	2.7	113.1	R331 K337	R331-R349 WeakPolarHBondContact CD-O 3.48Å; R331-R349 PolarHBondContact NH1-O 3.19Å; K337-R349 HydrophobicContact CG-CG 3.82Å
350	C	87.1	Confident	89.5	Confident	25 Å²	25	76.7 Å²	76.7	17%	0.169	40%	0.401	C	S	.	.	S	Bend	trans	-132.6	148.8	-177.5	62	0	0	0	0	112.5	Y339 S352 A353 F354	Y339-C350 VanDerWaalsContact CD2-C 3.49Å; C350-S352 VanDerWaalsContact C-N 3.33Å; C350-S352 PolarHBondContact O-N 3.47Å; C350-A353 PolarHBondContact O-N 3.37Å; C350-A353 WeakPolarHBondContact SG-CB 3.37Å; C350-F354 PolarHBondContact O-N 3.2Å
351	S	89.3	Confident	89.2	Confident	59 Å²	59	74 Å²	74	41%	0.413	39%	0.388	S	S	.	.	H	α-helix	trans	-67.2	-34.3	-177.5	63.2	0	0	0	0	112	Y339 A353 F354 V355	Y339-S351 VanDerWaalsContact CE2-N 3.28Å; S351-A353 PolarHBondContact O-N 3.41Å; S351-F354 WeakPolarHBondContact O-CB 3.25Å; S351-F354 PolarHBondContact O-N 2.74Å; S351-V355 WeakPolarHBondContact O-CB 3.5Å; S351-V355 VanDerWaalsContact O-CG2 3.27Å; S351-V355 WeakPolarHBondContact O-CG2 3.41Å; S351-V355 PolarHBondContact O-N 3.22Å
352	S	89.8	Confident	88.5	Confident	83 Å²	83	77.5 Å²	77.5	58%	0.58	42%	0.418	S	S	*	.	H	α-helix	trans	-63.6	-42.1	178.9	53.3	0	0	0	0	112.5	C350 F354 R356	C350-S352 VanDerWaalsContact C-N 3.33Å; C350-S352 PolarHBondContact O-N 3.47Å; S352-F354 VanDerWaalsContact C-N 3.35Å; S352-R356 WeakPolarHBondContact O-CB 3.32Å; S352-R356 PolarHBondContact O-N 3.14Å
353	A	89.6	Confident	87.4	Confident	19 Å²	19	75.6 Å²	75.6	16%	0.157	42%	0.416	C	S	.	.	H	α-helix	trans	-67.6	-37.7	174.6	0	0	0	0	0	111.8	F348 C350 S351 H357	F348-A353 HydrophobicContact CD1-CB 4.03Å; C350-A353 PolarHBondContact O-N 3.37Å; C350-A353 WeakPolarHBondContact SG-CB 3.37Å; S351-A353 PolarHBondContact O-N 3.41Å; A353-H357 WeakPolarHBondContact O-CB 3.39Å; A353-H357 PolarHBondContact O-N 2.84Å
354	F	90.9	Very high	85.6	Confident	30 Å²	30	79 Å²	79	13%	0.132	43%	0.432	C	S	.	.	H	α-helix	trans	-63.6	-50.9	175	174.7	-114.3	0	0	0	112.4	Y339 E340 C341 F348 C350 S351 S352 R356 H357 Q358	Y339-F354 HydrophobicContact CD1-CD1 4.49Å; Y339-F354 HydrophobicContact CG-CB 4.34Å; E340-F354 WeakPolarHBondContact O-CE2 3.3Å; C341-F354 HydrophobicContact CB-CE2 4.06Å; F348-F354 HydrophobicContact CB-CB 4.06Å; F348-F354 HydrophobicContact CD2-CB 4.15Å; F348-F354 AromaticContact CD2-CD2 3.72Å; F348-F354 HydrophobicContact CD2-CD2 3.72Å; F348-F354 HydrophobicContact CD2-CG 4.44Å; F348-F354 HydrophobicContact CE2-CD2 4.19Å; F348-F354 HydrophobicContact CG-CB 4.18Å; C350-F354 PolarHBondContact O-N 3.2Å; S351-F354 WeakPolarHBondContact O-CB 3.25Å; S351-F354 PolarHBondContact O-N 2.74Å; S352-F354 VanDerWaalsContact C-N 3.35Å; F354-R356 VanDerWaalsContact C-N 3.31Å; F354-R356 PolarHBondContact O-N 3.44Å; F354-H357 CarbonylContact O-C 3.4Å; F354-H357 WeakPolarHBondContact O-CA 3.48Å; F354-H357 WeakPolarHBondContact O-CB 3.49Å; F354-H357 PolarHBondContact O-N 3.39Å; F354-Q358 HydrophobicContact CD1-CG 4.47Å; F354-Q358 HydrophobicContact CD2-CG 4.31Å; F354-Q358 HydrophobicContact CE1-CG 4.09Å; F354-Q358 HydrophobicContact CE2-CG 3.9Å; F354-Q358 HydrophobicContact CZ-CG 3.8Å; F354-Q358 WeakPolarHBondContact O-CG 3.46Å; F354-Q358 PolarHBondContact O-N 3.03Å
355	V	90	Very high	85.3	Confident	62 Å²	62	80.4 Å²	80.4	38%	0.376	44%	0.436	S	S	.	.	H	α-helix	trans	-60.1	-42.5	177.9	170.2	0	0	0	0	110.7	S351 H357 Q358 R359	S351-V355 WeakPolarHBondContact O-CB 3.5Å; S351-V355 VanDerWaalsContact O-CG2 3.27Å; S351-V355 WeakPolarHBondContact O-CG2 3.41Å; S351-V355 PolarHBondContact O-N 3.22Å; V355-H357 VanDerWaalsContact C-N 3.27Å; V355-H357 PolarHBondContact O-N 2.81Å; V355-Q358 PolarHBondContact O-N 3.05Å; V355-R359 WeakPolarHBondContact O-CG 3.25Å; V355-R359 PolarHBondContact O-N 3.38Å; V355-R359 VanDerWaalsContact O-N 3.15Å
356	R	90.9	Very high	85.2	Confident	177 Å²	177	82.4 Å²	82.4	67%	0.668	44%	0.436	S	S	*	.	H	α-helix	trans	-61.2	-38.3	174	-177.8	175.6	62.5	-169.7	0.7	111.9	S352 F354	S352-R356 WeakPolarHBondContact O-CB 3.32Å; S352-R356 PolarHBondContact O-N 3.14Å; F354-R356 VanDerWaalsContact C-N 3.31Å; F354-R356 PolarHBondContact O-N 3.44Å
357	H	90.4	Very high	84.9	Confident	19 Å²	19	80.1 Å²	80.1	9%	0.088	43%	0.43	C	S	.	.	H	α-helix	trans	-68.1	-41.2	175.8	174	63.1	0	0	0	112.4	C344 F348 A353 F354 V355 R359 L360 H361	C344-H357 PolarHBondContact SG-NE2 3.1Å; F348-H357 HydrophobicContact CE1-CB 3.85Å; F348-H357 HydrophobicContact CE2-CB 3.88Å; F348-H357 AromaticContact CE2-CD2 3.35Å; F348-H357 WeakPolarHBondContact CE2-CD2 3.42Å; F348-H357 AromaticContact CE2-CG 3.65Å; F348-H357 HydrophobicContact CZ-CB 3.36Å; F348-H357 AromaticContact CZ-CD2 3.38Å; F348-H357 WeakPolarHBondContact CZ-CD2 3.42Å; F348-H357 AromaticContact CZ-CG 3.19Å; F348-H357 AromaticContact CZ-ND1 3.84Å; A353-H357 WeakPolarHBondContact O-CB 3.39Å; A353-H357 PolarHBondContact O-N 2.84Å; F354-H357 CarbonylContact O-C 3.4Å; F354-H357 WeakPolarHBondContact O-CA 3.48Å; F354-H357 WeakPolarHBondContact O-CB 3.49Å; F354-H357 PolarHBondContact O-N 3.39Å; V355-H357 VanDerWaalsContact C-N 3.27Å; V355-H357 PolarHBondContact O-N 2.81Å; H357-R359 PolarHBondContact O-N 3.46Å; H357-L360 VanDerWaalsContact O-CB 3.3Å; H357-L360 WeakPolarHBondContact O-CB 2.95Å; H357-L360 PolarHBondContact O-N 2.98Å; H357-L360 VanDerWaalsContact O-N 3.08Å; H357-H361 AromaticContact CE1-NE2 3.48Å; H357-H361 PolarHBondContact CE1-NE2 3.22Å; H357-H361 AromaticContact NE2-CD2 3.9Å; H357-H361 AromaticContact NE2-NE2 3.15Å; H357-H361 PolarHBondContact NE2-NE2 3.25Å; H357-H361 VanDerWaalsContact NE2-NE2 3.15Å
358	Q	87	Confident	84.6	Confident	78 Å²	78	82.8 Å²	82.8	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-60.5	-34.2	177.2	-71.8	-176.1	-62.3	0	0	112.5	F354 V355 L360 H361 A362	F354-Q358 HydrophobicContact CD1-CG 4.47Å; F354-Q358 HydrophobicContact CD2-CG 4.31Å; F354-Q358 HydrophobicContact CE1-CG 4.09Å; F354-Q358 HydrophobicContact CE2-CG 3.9Å; F354-Q358 HydrophobicContact CZ-CG 3.8Å; F354-Q358 WeakPolarHBondContact O-CG 3.46Å; F354-Q358 PolarHBondContact O-N 3.03Å; V355-Q358 PolarHBondContact O-N 3.05Å; Q358-L360 PolarHBondContact O-N 3.46Å; Q358-H361 PolarHBondContact O-N 2.85Å; Q358-H361 VanDerWaalsContact O-N 3.09Å; Q358-A362 PolarHBondContact O-N 3.11Å
359	R	89.6	Confident	84.3	Confident	142 Å²	142	85.4 Å²	85.4	54%	0.536	46%	0.455	S	S	.	.	H	α-helix	trans	-60.2	-31.3	175.3	-69.7	177.9	-170.9	-178.1	-2.3	113.4	V355 H357 H361 A362 G363 E364	V355-R359 WeakPolarHBondContact O-CG 3.25Å; V355-R359 PolarHBondContact O-N 3.38Å; V355-R359 VanDerWaalsContact O-N 3.15Å; H357-R359 PolarHBondContact O-N 3.46Å; R359-H361 PolarHBondContact O-N 3.05Å; R359-A362 CarbonylContact O-C 3.56Å; R359-A362 PolarHBondContact O-N 2.83Å; R359-A362 VanDerWaalsContact O-N 3.09Å; R359-G363 PolarHBondContact O-N 3.29Å; R359-G363 VanDerWaalsContact O-N 3.12Å; R359-E364 PolarHBondContact O-N 3.45Å
360	L	87.3	Confident	84.1	Confident	129 Å²	129	84 Å²	84	68%	0.675	46%	0.459	S	S	*	.	H	α-helix	trans	-65	-27.8	176.7	-59.6	172.9	0	0	0	112.7	H357 Q358	H357-L360 VanDerWaalsContact O-CB 3.3Å; H357-L360 WeakPolarHBondContact O-CB 2.95Å; H357-L360 PolarHBondContact O-N 2.98Å; H357-L360 VanDerWaalsContact O-N 3.08Å; Q358-L360 PolarHBondContact O-N 3.46Å
361	H	83.9	Confident	83.9	Confident	78 Å²	78	88.2 Å²	88.2	36%	0.361	48%	0.479	S	S	.	.	H	α-helix	trans	-84.8	-27.9	173.4	-59.2	-60.3	0	0	0	112.3	C341 E343 H357 Q358 R359 G363	C341-H361 PolarHBondContact SG-NE2 3.07Å; E343-H361 WeakPolarHBondContact OE2-CB 3.41Å; E343-H361 IonicContact OE2-CD2 3.85Å; E343-H361 PolarHBondContact OE2-CD2 2.95Å; E343-H361 IonicContact OE2-CG 3.66Å; E343-H361 IonicContact OE2-ND1 3.06Å; H357-H361 AromaticContact CE1-NE2 3.48Å; H357-H361 PolarHBondContact CE1-NE2 3.22Å; H357-H361 AromaticContact NE2-CD2 3.9Å; H357-H361 AromaticContact NE2-NE2 3.15Å; H357-H361 PolarHBondContact NE2-NE2 3.25Å; H357-H361 VanDerWaalsContact NE2-NE2 3.15Å; Q358-H361 PolarHBondContact O-N 2.85Å; Q358-H361 VanDerWaalsContact O-N 3.09Å; R359-H361 PolarHBondContact O-N 3.05Å; H361-G363 PolarHBondContact O-N 3.49Å
362	A	79	Confident	83.5	Confident	76 Å²	76	90.5 Å²	90.5	63%	0.628	49%	0.485	S	S	*	.	H	α-helix	trans	-76.1	-6.4	175.1	0	0	0	0	0	113.9	Q358 R359	Q358-A362 PolarHBondContact O-N 3.11Å; R359-A362 CarbonylContact O-C 3.56Å; R359-A362 PolarHBondContact O-N 2.83Å; R359-A362 VanDerWaalsContact O-N 3.09Å
363	G	65.4	Low	82.9	Confident	73 Å²	73	91.1 Å²	91.1	75%	0.753	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	20.9	176.6	0	0	0	0	0	115.2	R359 H361	R359-G363 PolarHBondContact O-N 3.29Å; R359-G363 VanDerWaalsContact O-N 3.12Å; H361-G363 PolarHBondContact O-N 3.49Å
364	E	51.1	Low	82.3	Confident	210 Å²	210	97.6 Å²	97.6	98%	0.981	51%	0.506	S	S	*	.			trans	-107.1	0	175.4	-75.1	-171.4	159.4	0	0	113.7	R359	R359-E364 PolarHBondContact O-N 3.45Å

Retrieved 364 of 364 residues in 63.5 ms (Link to these results)

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