A0A077ZAD7_TRITR Loading...

Zinc finger protein xfin zinc finger protein var iant

AlphaFold DB , UniProt , Accession A0A077ZAD7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 414 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	36.1	Very low	35.5	Very low	223 Å²	223	149.5 Å²	149.5	100%	1.099	78%	0.783	S	S	*	*				0	142.9	0	-55.2	-177.2	79.7	0	0	107.6
2	P	44.5	Very low	35.2	Very low	113 Å²	113	148.5 Å²	148.5	73%	0.734	78%	0.779	S	S	*	*			cis	-81.5	177	-20	3.4	19.6	0	0	0	108.9
3	E	31	Very low	34.9	Very low	172 Å²	172	149.8 Å²	149.8	80%	0.804	79%	0.787	S	S	*	*			cis	64.2	128.6	47.5	-58.7	172.3	119.8	0	0	112.3
4	A	33	Very low	34.5	Very low	97 Å²	97	151.8 Å²	151.8	80%	0.802	79%	0.79	S	S	*	*			cis	132.3	116.6	5.3	0	0	0	0	0	107.2
5	A	37.3	Very low	34.4	Very low	89 Å²	89	155.8 Å²	155.8	74%	0.736	80%	0.799	S	S	*	*			trans	-160.4	129.5	177	0	0	0	0	0	114.6
6	I	33.1	Very low	34.2	Very low	153 Å²	153	151.1 Å²	151.1	79%	0.785	79%	0.791	S	S	*	*				37.6	134	128.8	-27	174.4	0	0	0	117.2
7	V	34.9	Very low	34	Very low	126 Å²	126	148 Å²	148	76%	0.764	79%	0.792	S	S	*	*				-164.1	127.6	57.3	-176.4	0	0	0	0	108.3
8	K	33.4	Very low	33.8	Very low	159 Å²	159	147.7 Å²	147.7	69%	0.691	79%	0.79	S	S	*	*				78.2	117.5	63.6	-119.4	-158.5	172.9	-126.4	0	117.6	E10	K8-E10 IonicContact NZ-OE1 2.79Å; K8-E10 PolarHBondContact NZ-OE1 2.79Å
9	R	34.3	Very low	33.9	Very low	219 Å²	219	145.1 Å²	145.1	83%	0.826	79%	0.785	S	S	*	*			trans	172.6	121.3	143.3	-94.8	155.3	-174.7	175.9	4.8	108
10	E	35	Very low	33.7	Very low	116 Å²	116	145.7 Å²	145.7	54%	0.542	79%	0.787	S	S	.	*				69.3	128.2	69.6	-64	150.5	-159.5	0	0	109.6	K8	K8-E10 IonicContact NZ-OE1 2.79Å; K8-E10 PolarHBondContact NZ-OE1 2.79Å
11	Q	38	Very low	33.5	Very low	178 Å²	178	146.1 Å²	146.1	83%	0.832	78%	0.784	S	S	*	*			cis	-141	138.2	28.2	-63.5	173	-58.1	0	0	110.6
12	D	32.1	Very low	33.1	Very low	137 Å²	137	142 Å²	142	73%	0.733	77%	0.772	S	S	*	*				82	113.3	70.5	-49.5	-39.4	0	0	0	115.4
13	N	31	Very low	32.7	Very low	166 Å²	166	144.8 Å²	144.8	89%	0.888	77%	0.772	S	S	*	*			trans	-160.8	137.5	134.7	-147.2	-1.6	0	0	0	110.7
14	E	29.5	Very low	32.7	Very low	177 Å²	177	141.7 Å²	141.7	83%	0.827	77%	0.769	S	S	*	*			trans	-114.7	163.5	-175.1	-62.4	178.6	101.1	0	0	111.7
15	F	32.4	Very low	32.8	Very low	212 Å²	212	143.2 Å²	143.2	93%	0.93	77%	0.771	S	S	*	*			trans	160.9	150.1	145.4	-102	-75.3	0	0	0	110.6
16	A	31.8	Very low	32.5	Very low	81 Å²	81	146.3 Å²	146.3	67%	0.669	78%	0.775	S	S	*	*				-172.2	134.6	-77.7	0	0	0	0	0	109
17	A	30	Very low	32.4	Very low	98 Å²	98	143.9 Å²	143.9	81%	0.81	78%	0.777	S	S	*	*			trans	62.3	167.9	171.4	0	0	0	0	0	116.4
18	D	31.5	Very low	32.2	Very low	142 Å²	142	143.2 Å²	143.2	76%	0.759	78%	0.777	S	S	*	*			cis	-152.5	160.8	-0.6	-148.2	-34.8	0	0	0	112.7
19	S	34.7	Very low	32.1	Very low	98 Å²	98	141 Å²	141	69%	0.685	78%	0.782	S	S	*	*			trans	72.5	146.7	142.9	-78.9	0	0	0	0	124.2
20	L	30.6	Very low	32.1	Very low	158 Å²	158	138.4 Å²	138.4	83%	0.827	78%	0.779	S	S	*	*			trans	-72.7	151.7	-168.5	-66.5	58.5	0	0	0	114.1
21	E	29.6	Very low	32	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.724	79%	0.794	S	S	*	*				-155	135.4	124.8	-131.1	-172.2	-155.7	0	0	112.2	K23	E21-K23 WeakPolarHBondContact OE2-CE 3.44Å; E21-K23 IonicContact OE2-NZ 3.6Å; E21-K23 PolarHBondContact OE2-NZ 3.16Å
22	T	28.3	Very low	31.7	Very low	137 Å²	137	133 Å²	133	84%	0.84	78%	0.779	S	S	*	*			trans	-101.7	120.2	179.3	51.1	0	0	0	0	111.5
23	K	34.6	Very low	31.7	Very low	170 Å²	170	133.3 Å²	133.3	74%	0.739	78%	0.781	S	S	*	*			trans	-129.1	140.8	172.4	-79.7	167	176.2	149.5	0	111.2	E21	E21-K23 WeakPolarHBondContact OE2-CE 3.44Å; E21-K23 IonicContact OE2-NZ 3.6Å; E21-K23 PolarHBondContact OE2-NZ 3.16Å
24	S	32.3	Very low	32.1	Very low	107 Å²	107	127.9 Å²	127.9	75%	0.748	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-69.4	151.9	-172.5	-55.5	0	0	0	0	112.8	L26	S24-L26 PolarHBondContact O-N 2.77Å
25	P	34.2	Very low	32.5	Very low	130 Å²	130	123.4 Å²	123.4	84%	0.844	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-68.1	131.2	-172.2	27.2	-35.4	0	0	0	112.7
26	L	31.5	Very low	33.2	Very low	153 Å²	153	118.9 Å²	118.9	80%	0.801	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-72	128	169.3	-78.3	77.5	0	0	0	109.8	S24 C28	S24-L26 PolarHBondContact O-N 2.77Å; L26-C28 PolarHBondContact O-N 3.24Å
27	A	31.5	Very low	33.8	Very low	102 Å²	102	124 Å²	124	84%	0.843	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-75	120.8	173.5	0	0	0	0	0	110.5
28	C	30.8	Very low	34.1	Very low	113 Å²	113	122.6 Å²	122.6	76%	0.764	72%	0.723	S	S	*	*			trans	-89.5	110.1	174.8	-170.8	0	0	0	0	110.5	L26 E30	L26-C28 PolarHBondContact O-N 3.24Å; C28-E30 PolarHBondContact O-N 3.41Å
29	S	31	Very low	34.5	Very low	113 Å²	113	124.7 Å²	124.7	79%	0.79	73%	0.728	S	S	*	*			trans	-91	67.2	-175.9	60.3	0	0	0	0	113.1
30	E	33.5	Very low	35	Very low	163 Å²	163	123.4 Å²	123.4	76%	0.762	72%	0.719	S	S	*	*	S	Bend	trans	-165.8	115.2	161.7	-116	165.7	-139.3	0	0	112.9	C28 C32	C28-E30 PolarHBondContact O-N 3.41Å; E30-C32 PolarHBondContact O-N 3.46Å
31	A	33.1	Very low	35.7	Very low	103 Å²	103	121.8 Å²	121.8	85%	0.851	72%	0.716	S	S	*	*			trans	44.6	14.5	157.2	0	0	0	0	0	121	N33	A31-N33 PolarHBondContact O-N 2.7Å
32	C	32.7	Very low	36.6	Very low	77 Å²	77	122.2 Å²	122.2	52%	0.52	72%	0.723	S	S	.	*			trans	-78.8	117.4	176.7	-76.7	0	0	0	0	111.8	E30 G34 H35	E30-C32 PolarHBondContact O-N 3.46Å; C32-G34 PolarHBondContact O-N 2.76Å; C32-H35 HydrophobicContact CB-CB 4.3Å
33	N	31.2	Very low	38	Very low	144 Å²	144	117.2 Å²	117.2	77%	0.77	70%	0.695	S	S	*	*	S	Bend	trans	-70.4	71.1	175.2	-68.9	-25.6	0	0	0	111.8	A31 H35	A31-N33 PolarHBondContact O-N 2.7Å; N33-H35 VanDerWaalsContact C-N 3.35Å; N33-H35 PolarHBondContact O-N 3.37Å
34	G	39.2	Very low	39.2	Very low	52 Å²	52	111 Å²	111	54%	0.536	67%	0.671	S	S	.	*	S	Bend	trans	76.2	12.1	175.3	0	0	0	0	0	115.8	C32 S47	C32-G34 PolarHBondContact O-N 2.76Å; G34-S47 VanDerWaalsContact O-CB 3.27Å; G34-S47 WeakPolarHBondContact O-CB 3.31Å
35	H	38.6	Very low	40.3	Very low	84 Å²	84	107.4 Å²	107.4	39%	0.389	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-82.5	122.6	-177.3	-54.6	146.4	0	0	0	112.7	C32 N33	C32-H35 HydrophobicContact CB-CB 4.3Å; N33-H35 VanDerWaalsContact C-N 3.35Å; N33-H35 PolarHBondContact O-N 3.37Å
36	V	45.9	Very low	41.3	Very low	117 Å²	117	101.3 Å²	101.3	71%	0.709	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-92.3	122.7	164.6	-179.5	0	0	0	0	108.6
37	K	45.1	Very low	42.5	Very low	187 Å²	187	96.1 Å²	96.1	81%	0.813	59%	0.585	S	S	*	*	B	Isolated β-bridge	trans	-87.1	116.8	174	-170.7	-175.7	-179.3	-170.4	0	108.7
38	C	37	Very low	43.3	Very low	70 Å²	70	99.1 Å²	99.1	47%	0.473	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-74.1	139	171.5	-159.9	0	0	0	0	109.7	S40	C38-S40 VanDerWaalsContact C-N 3.33Å; C38-S40 PolarHBondContact SG-OG 3.23Å
39	E	39.9	Very low	44.4	Very low	185 Å²	185	96.5 Å²	96.5	86%	0.864	56%	0.564	S	S	*	*	S	Bend	trans	-81.4	-14.8	-179.5	-62	-168.4	131.6	0	0	112.7
40	S	45.4	Very low	45.6	Very low	71 Å²	71	100.2 Å²	100.2	50%	0.497	56%	0.562	S	S	.	*	S	Bend	trans	-84.2	119.5	171	62.5	0	0	0	0	112.3	C38	C38-S40 VanDerWaalsContact C-N 3.33Å; C38-S40 PolarHBondContact SG-OG 3.23Å
41	T	44.1	Very low	46.6	Very low	124 Å²	124	95.9 Å²	95.9	76%	0.761	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	68.3	155.2	58.3	0	0	0	0	117.6	A43	T41-A43 PolarHBondContact O-N 3.48Å
42	L	49.5	Very low	47.6	Very low	164 Å²	164	93.2 Å²	93.2	86%	0.859	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	-14.9	162.6	-90	101.5	0	0	0	120
43	A	56.2	Low	48.9	Very low	32 Å²	32	91 Å²	91	26%	0.264	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-72	136.8	-170.8	0	0	0	0	0	112.3	T41 L53	T41-A43 PolarHBondContact O-N 3.48Å; A43-L53 WeakPolarHBondContact CA-O 3.46Å
44	V	60	Low	50.3	Low	39 Å²	39	90 Å²	90	24%	0.236	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.2	171.9	-159.4	0	0	0	0	107.9	L53 A56 L59	V44-L53 PolarHBondContact N-O 3.22Å; V44-L53 PolarHBondContact O-N 3.13Å; V44-A56 HydrophobicContact CG2-CB 4.4Å; V44-L59 HydrophobicContact CB-CD2 4.15Å; V44-L59 HydrophobicContact CG1-CD2 3.51Å
45	A	56.9	Low	51.3	Low	32 Å²	32	90.6 Å²	90.6	26%	0.264	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	138	176.1	0	0	0	0	0	110.9	V51	A45-V51 WeakPolarHBondContact CA-O 3.18Å
46	C	55	Low	52.3	Low	2 Å²	2	89 Å²	89	1%	0.014	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-70.6	127.7	167.1	179.2	0	0	0	0	110.1	E48 C49 Y50 V51 L59 H62	C46-E48 VanDerWaalsContact C-N 3.3Å; C46-E48 PolarHBondContact O-N 3.14Å; C46-C49 VanDerWaalsContact SG-SG 3.67Å; C46-Y50 WeakPolarHBondContact O-CA 3.48Å; C46-Y50 PolarHBondContact O-N 3.12Å; C46-V51 PolarHBondContact N-O 2.87Å; C46-L59 HydrophobicContact CB-CD1 3.8Å; C46-H62 PolarHBondContact SG-NE2 2.85Å
47	S	55.7	Low	52.9	Low	45 Å²	45	88.6 Å²	88.6	32%	0.315	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-20.6	-177.9	44.1	0	0	0	0	114.5	G34	G34-S47 VanDerWaalsContact O-CB 3.27Å; G34-S47 WeakPolarHBondContact O-CB 3.31Å
48	E	49	Very low	53.4	Low	165 Å²	165	83.4 Å²	83.4	77%	0.771	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-26.9	179.4	-64.9	-173.2	-179.3	0	0	113.8	C46	C46-E48 VanDerWaalsContact C-N 3.3Å; C46-E48 PolarHBondContact O-N 3.14Å
49	C	53.6	Low	54.1	Low	58 Å²	58	80.5 Å²	80.5	39%	0.392	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-0.9	-175.5	76	0	0	0	0	115.8	C46 V51 H62	C46-C49 VanDerWaalsContact SG-SG 3.67Å; C49-V51 PolarHBondContact O-N 3.38Å; C49-H62 PolarHBondContact SG-CE1 3.27Å; C49-H62 PolarHBondContact SG-NE2 2.94Å
50	Y	56	Low	54.8	Low	191 Å²	191	80 Å²	80	75%	0.749	44%	0.444	S	S	*	.			trans	58.6	10.6	176.4	-55.7	-86.4	0	0	0	116.2	C46 G52	C46-Y50 WeakPolarHBondContact O-CA 3.48Å; C46-Y50 PolarHBondContact O-N 3.12Å; Y50-G52 PolarHBondContact O-N 3.29Å
51	V	55.2	Low	55.1	Low	71 Å²	71	77.8 Å²	77.8	43%	0.43	43%	0.432	S	S	.	.			trans	-65.6	118.5	170.1	177.8	0	0	0	0	108.8	A45 C46 C49 L53	A45-V51 WeakPolarHBondContact CA-O 3.18Å; C46-V51 PolarHBondContact N-O 2.87Å; C49-V51 PolarHBondContact O-N 3.38Å; V51-L53 HydrophobicContact CG1-CD2 3.86Å; V51-L53 HydrophobicContact CG1-CG 4.17Å
52	G	53.2	Low	55.4	Low	47 Å²	47	73.2 Å²	73.2	49%	0.485	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	133.7	168.1	0	0	0	0	0	110.7	Y50	Y50-G52 PolarHBondContact O-N 3.29Å
53	L	61.1	Low	55.3	Low	32 Å²	32	70.3 Å²	70.3	17%	0.168	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.4	179.3	-62.9	171.6	0	0	0	109.7	A43 V44 V51 N55 L58 L59 H62	A43-L53 WeakPolarHBondContact CA-O 3.46Å; V44-L53 PolarHBondContact N-O 3.22Å; V44-L53 PolarHBondContact O-N 3.13Å; V51-L53 HydrophobicContact CG1-CD2 3.86Å; V51-L53 HydrophobicContact CG1-CG 4.17Å; L53-N55 PolarHBondContact O-N 3.3Å; L53-L58 HydrophobicContact CB-CB 4.07Å; L53-L59 HydrophobicContact CD1-CB 4.03Å; L53-L59 HydrophobicContact CD1-CD1 3.88Å; L53-H62 HydrophobicContact CD1-CB 3.79Å
54	D	58.8	Low	54.7	Low	122 Å²	122	77.5 Å²	77.5	65%	0.652	40%	0.403	S	S	*	.	S	Bend	trans	-62.2	-15.9	-167.2	-45.4	-42.1	0	0	0	114.8	L58	D54-L58 HydrophobicContact CB-CD1 4.07Å
55	N	60.5	Low	53.5	Low	64 Å²	64	81.2 Å²	81.2	34%	0.342	43%	0.428	S	S	.	.	S	Bend	trans	-162.3	165	176.7	61	76.1	0	0	0	113	L53 N57 L58 L59	L53-N55 PolarHBondContact O-N 3.3Å; N55-N57 PolarHBondContact O-N 3.36Å; N55-N57 WeakPolarHBondContact OD1-CA 3.45Å; N55-N57 VanDerWaalsContact OD1-CB 3.26Å; N55-N57 WeakPolarHBondContact OD1-CB 3.25Å; N55-N57 PolarHBondContact OD1-N 3.23Å; N55-L58 PolarHBondContact O-N 2.7Å; N55-L58 PolarHBondContact OD1-N 3.11Å; N55-L59 PolarHBondContact O-N 3.35Å
56	A	61.3	Low	52.6	Low	51 Å²	51	82 Å²	82	42%	0.421	44%	0.439	S	S	.	.	H	α-helix	trans	-68	-10.6	178.7	0	0	0	0	0	115.2	V44 R60	V44-A56 HydrophobicContact CG2-CB 4.4Å; A56-R60 WeakPolarHBondContact O-CB 3.15Å; A56-R60 WeakPolarHBondContact O-CG 3.25Å; A56-R60 PolarHBondContact O-N 3.3Å; A56-R60 PolarHBondContact O-NE 3.42Å
57	N	58.1	Low	51.9	Low	108 Å²	108	84.4 Å²	84.4	58%	0.578	46%	0.456	S	S	*	.	H	α-helix	trans	-81.1	-38.2	172.1	-64	-25.9	0	0	0	111	N55 L59 R60 G61	N55-N57 PolarHBondContact O-N 3.36Å; N55-N57 WeakPolarHBondContact OD1-CA 3.45Å; N55-N57 VanDerWaalsContact OD1-CB 3.26Å; N55-N57 WeakPolarHBondContact OD1-CB 3.25Å; N55-N57 PolarHBondContact OD1-N 3.23Å; N57-L59 VanDerWaalsContact C-N 3.35Å; N57-R60 PolarHBondContact O-N 2.87Å; N57-R60 PolarHBondContact OD1-NH2 2.85Å; N57-G61 PolarHBondContact O-N 2.99Å
58	L	54.4	Low	50.8	Low	78 Å²	78	87.2 Å²	87.2	41%	0.408	46%	0.46	S	S	.	.	H	α-helix	trans	-62.9	-40.7	169.8	-67.1	173	0	0	0	111.1	L53 D54 N55 G61 H62	L53-L58 HydrophobicContact CB-CB 4.07Å; D54-L58 HydrophobicContact CB-CD1 4.07Å; N55-L58 PolarHBondContact O-N 2.7Å; N55-L58 PolarHBondContact OD1-N 3.11Å; L58-G61 CarbonylContact O-C 3.58Å; L58-G61 VanDerWaalsContact O-CA 3.28Å; L58-G61 WeakPolarHBondContact O-CA 3.29Å; L58-G61 PolarHBondContact O-N 3.48Å; L58-G61 VanDerWaalsContact O-N 3.07Å; L58-H62 PolarHBondContact O-N 2.93Å
59	L	53.4	Low	50	Low	10 Å²	10	84 Å²	84	5%	0.052	45%	0.448	C	S	.	.	H	α-helix	trans	-67.2	-37.5	174.1	-174	64.8	0	0	0	112.9	V44 C46 L53 N55 N57 G61 H62 F63	V44-L59 HydrophobicContact CB-CD2 4.15Å; V44-L59 HydrophobicContact CG1-CD2 3.51Å; C46-L59 HydrophobicContact CB-CD1 3.8Å; L53-L59 HydrophobicContact CD1-CB 4.03Å; L53-L59 HydrophobicContact CD1-CD1 3.88Å; N55-L59 PolarHBondContact O-N 3.35Å; N57-L59 VanDerWaalsContact C-N 3.35Å; L59-G61 PolarHBondContact O-N 3.49Å; L59-H62 HydrophobicContact CD1-CB 4.31Å; L59-H62 WeakPolarHBondContact O-CB 3.33Å; L59-H62 PolarHBondContact O-N 2.85Å; L59-F63 HydrophobicContact CD1-CD2 4.47Å; L59-F63 HydrophobicContact CD1-CE2 3.81Å; L59-F63 HydrophobicContact CD1-CZ 4.45Å; L59-F63 HydrophobicContact CG-CD2 4.45Å; L59-F63 HydrophobicContact CG-CE2 3.94Å; L59-F63 VanDerWaalsContact O-CD2 3.26Å; L59-F63 WeakPolarHBondContact O-CD2 3.43Å; L59-F63 PolarHBondContact O-N 3.29Å
60	R	52.7	Low	49.3	Very low	174 Å²	174	88.1 Å²	88.1	66%	0.657	46%	0.459	S	S	*	.	H	α-helix	trans	-65.9	-27.9	168.5	-79.2	-173.8	-73	-152.1	0.9	112.8	A56 N57	A56-R60 WeakPolarHBondContact O-CB 3.15Å; A56-R60 WeakPolarHBondContact O-CG 3.25Å; A56-R60 PolarHBondContact O-N 3.3Å; A56-R60 PolarHBondContact O-NE 3.42Å; N57-R60 PolarHBondContact O-N 2.87Å; N57-R60 PolarHBondContact OD1-NH2 2.85Å
61	G	52	Low	48.4	Very low	25 Å²	25	87.1 Å²	87.1	26%	0.258	46%	0.459	S	S	.	.	H	α-helix	trans	-61.3	-52.3	166.8	0	0	0	0	0	111.3	N57 L58 L59 F63 R64 S67	N57-G61 PolarHBondContact O-N 2.99Å; L58-G61 CarbonylContact O-C 3.58Å; L58-G61 VanDerWaalsContact O-CA 3.28Å; L58-G61 WeakPolarHBondContact O-CA 3.29Å; L58-G61 PolarHBondContact O-N 3.48Å; L58-G61 VanDerWaalsContact O-N 3.07Å; L59-G61 PolarHBondContact O-N 3.49Å; G61-F63 PolarHBondContact O-N 2.98Å; G61-F63 VanDerWaalsContact O-N 3.12Å; G61-R64 VanDerWaalsContact O-CB 3.29Å; G61-R64 WeakPolarHBondContact O-CB 3.34Å; G61-R64 PolarHBondContact O-N 2.99Å; G61-S67 WeakPolarHBondContact O-CB 3.23Å; G61-S67 PolarHBondContact O-OG 2.82Å
62	H	52	Low	48	Very low	28 Å²	28	88.4 Å²	88.4	13%	0.13	46%	0.463	C	S	.	.	H	α-helix	trans	-58.1	-19.3	-175.8	179.5	75.5	0	0	0	116	C46 C49 L53 L58 L59 S67	C46-H62 PolarHBondContact SG-NE2 2.85Å; C49-H62 PolarHBondContact SG-CE1 3.27Å; C49-H62 PolarHBondContact SG-NE2 2.94Å; L53-H62 HydrophobicContact CD1-CB 3.79Å; L58-H62 PolarHBondContact O-N 2.93Å; L59-H62 HydrophobicContact CD1-CB 4.31Å; L59-H62 WeakPolarHBondContact O-CB 3.33Å; L59-H62 PolarHBondContact O-N 2.85Å; H62-S67 WeakPolarHBondContact CA-OG 3.26Å; H62-S67 PolarHBondContact O-OG 2.86Å
63	F	47	Very low	47.8	Very low	102 Å²	102	87.3 Å²	87.3	45%	0.447	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-0.3	172.5	-69	-70	0	0	0	114	L59 G61	L59-F63 HydrophobicContact CD1-CD2 4.47Å; L59-F63 HydrophobicContact CD1-CE2 3.81Å; L59-F63 HydrophobicContact CD1-CZ 4.45Å; L59-F63 HydrophobicContact CG-CD2 4.45Å; L59-F63 HydrophobicContact CG-CE2 3.94Å; L59-F63 VanDerWaalsContact O-CD2 3.26Å; L59-F63 WeakPolarHBondContact O-CD2 3.43Å; L59-F63 PolarHBondContact O-N 3.29Å; G61-F63 PolarHBondContact O-N 2.98Å; G61-F63 VanDerWaalsContact O-N 3.12Å
64	R	42.8	Very low	46.9	Very low	184 Å²	184	87.3 Å²	87.3	69%	0.694	45%	0.449	S	S	*	.	S	Bend	trans	-74.4	141.1	172	-76.3	-177.5	162.2	167.2	-6.3	111.1	G61 G66 S67 Y68	G61-R64 VanDerWaalsContact O-CB 3.29Å; G61-R64 WeakPolarHBondContact O-CB 3.34Å; G61-R64 PolarHBondContact O-N 2.99Å; R64-G66 PolarHBondContact O-N 3.38Å; R64-S67 PolarHBondContact N-OG 3.28Å; R64-S67 PolarHBondContact O-N 3.49Å; R64-S67 PolarHBondContact O-OG 3.25Å; R64-Y68 WeakPolarHBondContact O-CD1 3.41Å; R64-Y68 VanDerWaalsContact O-CE1 3.3Å; R64-Y68 WeakPolarHBondContact O-CE1 3.48Å
65	P	34.1	Very low	46.3	Very low	117 Å²	117	81.9 Å²	81.9	76%	0.76	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	114.1	172.2	-28.4	36.1	0	0	0	112.4
66	G	39.7	Very low	45.7	Very low	49 Å²	49	88.4 Å²	88.4	51%	0.505	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	108	-3.8	-179.1	0	0	0	0	0	116.3	R64	R64-G66 PolarHBondContact O-N 3.38Å
67	S	39.5	Very low	44.9	Very low	52 Å²	52	91.8 Å²	91.8	36%	0.364	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-17.5	-179.4	63.6	0	0	0	0	114.7	G61 H62 R64	G61-S67 WeakPolarHBondContact O-CB 3.23Å; G61-S67 PolarHBondContact O-OG 2.82Å; H62-S67 WeakPolarHBondContact CA-OG 3.26Å; H62-S67 PolarHBondContact O-OG 2.86Å; R64-S67 PolarHBondContact N-OG 3.28Å; R64-S67 PolarHBondContact O-N 3.49Å; R64-S67 PolarHBondContact O-OG 3.25Å
68	Y	31.9	Very low	44	Very low	103 Å²	103	89.8 Å²	89.8	40%	0.404	44%	0.443	S	S	.	.	S	Bend	trans	-90.6	154.2	160.4	52.9	-91	0	0	0	109.7	R64	R64-Y68 WeakPolarHBondContact O-CD1 3.41Å; R64-Y68 VanDerWaalsContact O-CE1 3.3Å; R64-Y68 WeakPolarHBondContact O-CE1 3.48Å
69	L	33.3	Very low	43.5	Very low	98 Å²	98	90.7 Å²	90.7	51%	0.513	45%	0.448	S	S	.	.	S	Bend	trans	96.4	143.3	-171.1	-62	154.3	0	0	0	114.8	L73 V81	L69-L73 HydrophobicContact CD2-CD1 4.17Å; L69-V81 HydrophobicContact CB-CG1 3.81Å; L69-V81 HydrophobicContact CD1-CG1 3.5Å; L69-V81 HydrophobicContact CG-CG1 4.28Å
70	K	38.9	Very low	42.8	Very low	144 Å²	144	91.4 Å²	91.4	63%	0.626	46%	0.457	S	S	*	.			trans	-57.5	147.4	-169.7	-67.6	-179.9	172.3	-176.1	0	112.8	D72 L73	K70-D72 HydrophobicContact CB-CB 4.37Å; K70-D72 PolarHBondContact O-N 3.18Å; K70-L73 HydrophobicContact CB-CB 4.47Å; K70-L73 HydrophobicContact CB-CD1 4.19Å; K70-L73 HydrophobicContact CB-CG 4.11Å; K70-L73 WeakPolarHBondContact O-CB 3.4Å; K70-L73 PolarHBondContact O-N 3.38Å
71	K	36.6	Very low	42.3	Very low	170 Å²	170	85.7 Å²	85.7	74%	0.739	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-17	167.5	-168.2	171.6	-177	172	0	113.6
72	D	46.7	Very low	41.8	Very low	99 Å²	99	86.6 Å²	86.6	53%	0.529	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.8	176.7	-36.8	-58.4	0	0	0	113.5	K70 R88	K70-D72 HydrophobicContact CB-CB 4.37Å; K70-D72 PolarHBondContact O-N 3.18Å; D72-R88 WeakPolarHBondContact O-CD 3.31Å; D72-R88 PolarHBondContact O-NE 3.29Å
73	L	49.6	Very low	41.4	Very low	24 Å²	24	90.1 Å²	90.1	13%	0.126	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-6.1	-174.7	-68.5	179.7	0	0	0	114	L69 K70 F82 S84 D85	L69-L73 HydrophobicContact CD2-CD1 4.17Å; K70-L73 HydrophobicContact CB-CB 4.47Å; K70-L73 HydrophobicContact CB-CD1 4.19Å; K70-L73 HydrophobicContact CB-CG 4.11Å; K70-L73 WeakPolarHBondContact O-CB 3.4Å; K70-L73 PolarHBondContact O-N 3.38Å; L73-F82 PolarHBondContact O-N 3.42Å; L73-F82 VanDerWaalsContact O-N 3.08Å; L73-S84 VanDerWaalsContact CD2-C 3.46Å; L73-D85 HydrophobicContact CD2-CB 3.98Å
74	C	41.6	Very low	41.4	Very low	32 Å²	32	87.8 Å²	87.8	22%	0.216	47%	0.469	C	S	.	.	B	Isolated β-bridge	trans	-92.2	147.8	173.3	63.2	0	0	0	0	112.4	G80 V81 R88	C74-G80 CarbonylContact C-O 3.58Å; C74-G80 WeakPolarHBondContact CA-O 3.35Å; C74-V81 HydrophobicContact CB-CG2 4.45Å; C74-R88 VanDerWaalsContact O-CD 3.25Å; C74-R88 WeakPolarHBondContact O-CD 3.39Å
75	C	46.4	Very low	42	Very low	7 Å²	7	81.2 Å²	81.2	5%	0.047	45%	0.448	C	S	.	.			trans	-75.8	127.2	167.8	-177.5	0	0	0	0	110.2	I77 L79 G80 F82 H91 H95	C75-I77 PolarHBondContact O-N 2.87Å; C75-I77 PolarHBondContact SG-N 3.48Å; C75-L79 WeakPolarHBondContact O-CA 3.48Å; C75-L79 PolarHBondContact O-N 3.29Å; C75-G80 PolarHBondContact N-O 3.46Å; C75-F82 HydrophobicContact CB-CE2 4.07Å; C75-H91 VanDerWaalsContact CB-NE2 3.34Å; C75-H91 WeakPolarHBondContact CB-NE2 3.43Å; C75-H91 PolarHBondContact SG-NE2 2.98Å; C75-H95 PolarHBondContact SG-CD2 3.47Å; C75-H95 PolarHBondContact SG-NE2 2.83Å; C75-H95 VanDerWaalsContact SG-NE2 3.38Å
76	R	48.9	Very low	43.3	Very low	201 Å²	201	80.2 Å²	80.2	76%	0.758	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-4.3	179.8	-63.4	-171.2	-178.3	-173.1	2.8	114.6
77	I	43.6	Very low	43.7	Very low	123 Å²	123	79.6 Å²	79.6	63%	0.631	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-40.9	-174.9	-58.5	172	0	0	0	111.6	C75 H95	C75-I77 PolarHBondContact O-N 2.87Å; C75-I77 PolarHBondContact SG-N 3.48Å; I77-H95 HydrophobicContact CD1-CB 3.55Å; I77-H95 HydrophobicContact CG2-CB 4.43Å; I77-H95 WeakPolarHBondContact CG2-ND1 3.46Å
78	C	40.1	Very low	44.5	Very low	65 Å²	65	80.3 Å²	80.3	44%	0.439	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	1.1	177.3	72.6	0	0	0	0	114.8	G80 H91	C78-G80 PolarHBondContact O-N 3.24Å; C78-G80 PolarHBondContact SG-N 2.92Å; C78-H91 PolarHBondContact SG-CE1 3.2Å; C78-H91 PolarHBondContact SG-NE2 3.19Å
79	L	43.1	Very low	45.9	Very low	98 Å²	98	83.1 Å²	83.1	51%	0.513	44%	0.437	S	S	.	.			trans	57.4	12.9	-175.6	-56.6	177.8	0	0	0	115.5	C75 V81 V397	C75-L79 WeakPolarHBondContact O-CA 3.48Å; C75-L79 PolarHBondContact O-N 3.29Å; L79-V81 PolarHBondContact O-N 2.8Å; L79-V397 HydrophobicContact CD1-CB 4.4Å; L79-V397 HydrophobicContact CD1-CG1 4.22Å; L79-V397 HydrophobicContact CD1-CG2 3.99Å
80	G	39.3	Very low	47.1	Very low	24 Å²	24	79.3 Å²	79.3	25%	0.247	42%	0.42	C	S	.	.			trans	-56.9	136.6	169.9	0	0	0	0	0	111.7	C74 C75 C78 F82	C74-G80 CarbonylContact C-O 3.58Å; C74-G80 WeakPolarHBondContact CA-O 3.35Å; C75-G80 PolarHBondContact N-O 3.46Å; C78-G80 PolarHBondContact O-N 3.24Å; C78-G80 PolarHBondContact SG-N 2.92Å; G80-F82 VanDerWaalsContact C-CE2 3.47Å; G80-F82 WeakPolarHBondContact O-CD2 3.47Å; G80-F82 WeakPolarHBondContact O-CE2 3.13Å
81	V	41.6	Very low	48.1	Very low	55 Å²	55	73.6 Å²	73.6	33%	0.333	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-108.4	132.3	-174.7	-176.9	0	0	0	0	110.1	L69 C74 L79	L69-V81 HydrophobicContact CB-CG1 3.81Å; L69-V81 HydrophobicContact CD1-CG1 3.5Å; L69-V81 HydrophobicContact CG-CG1 4.28Å; C74-V81 HydrophobicContact CB-CG2 4.45Å; L79-V81 PolarHBondContact O-N 2.8Å
82	F	41.8	Very low	49.2	Very low	43 Å²	43	66.6 Å²	66.6	19%	0.189	37%	0.369	C	S	.	.			trans	-120.5	140.3	-170.9	-62.8	-83.4	0	0	0	112.7	L73 C75 G80 S84 A87 R88 H91	L73-F82 PolarHBondContact O-N 3.42Å; L73-F82 VanDerWaalsContact O-N 3.08Å; C75-F82 HydrophobicContact CB-CE2 4.07Å; G80-F82 VanDerWaalsContact C-CE2 3.47Å; G80-F82 WeakPolarHBondContact O-CD2 3.47Å; G80-F82 WeakPolarHBondContact O-CE2 3.13Å; F82-S84 PolarHBondContact O-N 3.28Å; F82-A87 HydrophobicContact CB-CB 4.09Å; F82-A87 HydrophobicContact CD1-CB 4.13Å; F82-A87 HydrophobicContact CG-CB 4.47Å; F82-R88 HydrophobicContact CB-CB 4.04Å; F82-R88 HydrophobicContact CD2-CB 3.98Å; F82-R88 HydrophobicContact CD2-CG 4.1Å; F82-R88 HydrophobicContact CG-CB 4.15Å; F82-H91 HydrophobicContact CD1-CB 4.41Å; F82-H91 HydrophobicContact CE1-CB 3.64Å; F82-H91 AromaticContact CE1-CG 3.81Å; F82-H91 HydrophobicContact CE2-CB 4.1Å; F82-H91 AromaticContact CE2-CD2 3.33Å; F82-H91 WeakPolarHBondContact CE2-CD2 3.37Å; F82-H91 AromaticContact CE2-CG 3.71Å; F82-H91 AromaticContact CE2-NE2 3.95Å; F82-H91 HydrophobicContact CZ-CB 3.48Å; F82-H91 VanDerWaalsContact CZ-CB 3.48Å; F82-H91 AromaticContact CZ-CD2 3.26Å; F82-H91 WeakPolarHBondContact CZ-CD2 3.37Å; F82-H91 AromaticContact CZ-CG 3.14Å; F82-H91 AromaticContact CZ-ND1 3.67Å; F82-H91 AromaticContact CZ-NE2 3.83Å
83	A	42.5	Very low	49.8	Very low	102 Å²	102	66.2 Å²	66.2	84%	0.843	36%	0.36	S	S	*	.	S	Bend	trans	-68.8	-11.3	179.7	0	0	0	0	0	114.3
84	S	47.4	Very low	49.9	Very low	54 Å²	54	67.3 Å²	67.3	38%	0.378	37%	0.366	S	S	.	.	S	Bend	trans	-153.4	154.6	174.2	71.8	0	0	0	0	111.6	L73 F82 C86 A87 R88	L73-S84 VanDerWaalsContact CD2-C 3.46Å; F82-S84 PolarHBondContact O-N 3.28Å; S84-C86 PolarHBondContact O-N 3.25Å; S84-A87 WeakPolarHBondContact O-CB 3.32Å; S84-A87 PolarHBondContact O-N 3.39Å; S84-A87 PolarHBondContact OG-N 3.15Å; S84-R88 PolarHBondContact O-N 2.94Å
85	D	55.4	Low	50.6	Low	45 Å²	45	68.8 Å²	68.8	24%	0.241	37%	0.369	C	S	.	.	H	α-helix	trans	-65.6	-29.7	177.9	-178.7	53.2	0	0	0	111.7	L73 A87 R88 R89	L73-D85 HydrophobicContact CD2-CB 3.98Å; D85-A87 PolarHBondContact O-N 3.48Å; D85-R88 PolarHBondContact O-N 3.37Å; D85-R88 IonicContact OD1-CZ 3.63Å; D85-R88 IonicContact OD1-NE 2.68Å; D85-R88 PolarHBondContact OD1-NE 2.95Å; D85-R88 IonicContact OD1-NH2 2.7Å; D85-R88 PolarHBondContact OD1-NH2 3.35Å; D85-R89 WeakPolarHBondContact O-CB 3.43Å; D85-R89 VanDerWaalsContact O-CG 3.31Å; D85-R89 WeakPolarHBondContact O-CG 3.36Å; D85-R89 PolarHBondContact O-N 3.46Å; D85-R89 IonicContact OD2-CZ 3.15Å; D85-R89 IonicContact OD2-NE 2.76Å; D85-R89 PolarHBondContact OD2-NE 3.03Å; D85-R89 IonicContact OD2-NH2 2.7Å; D85-R89 PolarHBondContact OD2-NH2 3.29Å
86	C	60.8	Low	51	Low	96 Å²	96	74 Å²	74	65%	0.649	39%	0.393	S	S	*	.	H	α-helix	trans	-59.9	-44.6	170	-174.3	0	0	0	0	111.5	S84 R89 A90	S84-C86 PolarHBondContact O-N 3.25Å; C86-R89 PolarHBondContact O-N 3.2Å; C86-A90 VanDerWaalsContact O-CB 3.25Å; C86-A90 WeakPolarHBondContact O-CB 3.31Å; C86-A90 PolarHBondContact O-N 3.49Å
87	A	48.3	Very low	51.1	Low	36 Å²	36	70.5 Å²	70.5	30%	0.298	39%	0.389	S	S	.	.	H	α-helix	trans	-66.5	-39.3	175.6	0	0	0	0	0	112.3	F82 S84 D85 A90 H91	F82-A87 HydrophobicContact CB-CB 4.09Å; F82-A87 HydrophobicContact CD1-CB 4.13Å; F82-A87 HydrophobicContact CG-CB 4.47Å; S84-A87 WeakPolarHBondContact O-CB 3.32Å; S84-A87 PolarHBondContact O-N 3.39Å; S84-A87 PolarHBondContact OG-N 3.15Å; D85-A87 PolarHBondContact O-N 3.48Å; A87-A90 PolarHBondContact O-N 3.12Å; A87-H91 WeakPolarHBondContact O-CB 3.21Å; A87-H91 PolarHBondContact O-N 3.45Å
88	R	57.4	Low	51.6	Low	68 Å²	68	70.6 Å²	70.6	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-60.3	-49.9	173.3	-173.8	-165.1	62.5	93	-2.6	111.8	D72 C74 F82 S84 D85 H91 A92	D72-R88 WeakPolarHBondContact O-CD 3.31Å; D72-R88 PolarHBondContact O-NE 3.29Å; C74-R88 VanDerWaalsContact O-CD 3.25Å; C74-R88 WeakPolarHBondContact O-CD 3.39Å; F82-R88 HydrophobicContact CB-CB 4.04Å; F82-R88 HydrophobicContact CD2-CB 3.98Å; F82-R88 HydrophobicContact CD2-CG 4.1Å; F82-R88 HydrophobicContact CG-CB 4.15Å; S84-R88 PolarHBondContact O-N 2.94Å; D85-R88 PolarHBondContact O-N 3.37Å; D85-R88 IonicContact OD1-CZ 3.63Å; D85-R88 IonicContact OD1-NE 2.68Å; D85-R88 PolarHBondContact OD1-NE 2.95Å; D85-R88 IonicContact OD1-NH2 2.7Å; D85-R88 PolarHBondContact OD1-NH2 3.35Å; R88-H91 PolarHBondContact O-N 3.06Å; R88-A92 PolarHBondContact O-N 3.43Å
89	R	60.3	Low	52.3	Low	161 Å²	161	68 Å²	68	61%	0.608	37%	0.37	S	S	*	.	H	α-helix	trans	-61.1	-42.7	175.9	-68.6	-177.4	-148.4	-173.4	6.8	111.6	D85 C86 H91 A92 R93	D85-R89 WeakPolarHBondContact O-CB 3.43Å; D85-R89 VanDerWaalsContact O-CG 3.31Å; D85-R89 WeakPolarHBondContact O-CG 3.36Å; D85-R89 PolarHBondContact O-N 3.46Å; D85-R89 IonicContact OD2-CZ 3.15Å; D85-R89 IonicContact OD2-NE 2.76Å; D85-R89 PolarHBondContact OD2-NE 3.03Å; D85-R89 IonicContact OD2-NH2 2.7Å; D85-R89 PolarHBondContact OD2-NH2 3.29Å; C86-R89 PolarHBondContact O-N 3.2Å; R89-H91 VanDerWaalsContact C-N 3.27Å; R89-H91 PolarHBondContact O-N 2.79Å; R89-A92 PolarHBondContact O-N 2.93Å; R89-R93 PolarHBondContact O-N 3.28Å
90	A	59.8	Low	53.3	Low	19 Å²	19	67 Å²	67	16%	0.157	37%	0.369	C	S	.	.	H	α-helix	trans	-61.4	-37.8	178.5	0	0	0	0	0	111.9	C86 A87 T111	C86-A90 VanDerWaalsContact O-CB 3.25Å; C86-A90 WeakPolarHBondContact O-CB 3.31Å; C86-A90 PolarHBondContact O-N 3.49Å; A87-A90 PolarHBondContact O-N 3.12Å; A90-T111 HydrophobicContact CB-CG2 4.24Å
91	H	59.4	Low	54.6	Low	24 Å²	24	68.9 Å²	68.9	11%	0.111	37%	0.371	C	S	.	.	H	α-helix	trans	-74.7	-36.2	173.7	161	77.3	0	0	0	113.5	C75 C78 F82 A87 R88 R89 R93 I94 H95	C75-H91 VanDerWaalsContact CB-NE2 3.34Å; C75-H91 WeakPolarHBondContact CB-NE2 3.43Å; C75-H91 PolarHBondContact SG-NE2 2.98Å; C78-H91 PolarHBondContact SG-CE1 3.2Å; C78-H91 PolarHBondContact SG-NE2 3.19Å; F82-H91 HydrophobicContact CD1-CB 4.41Å; F82-H91 HydrophobicContact CE1-CB 3.64Å; F82-H91 AromaticContact CE1-CG 3.81Å; F82-H91 HydrophobicContact CE2-CB 4.1Å; F82-H91 AromaticContact CE2-CD2 3.33Å; F82-H91 WeakPolarHBondContact CE2-CD2 3.37Å; F82-H91 AromaticContact CE2-CG 3.71Å; F82-H91 AromaticContact CE2-NE2 3.95Å; F82-H91 HydrophobicContact CZ-CB 3.48Å; F82-H91 VanDerWaalsContact CZ-CB 3.48Å; F82-H91 AromaticContact CZ-CD2 3.26Å; F82-H91 WeakPolarHBondContact CZ-CD2 3.37Å; F82-H91 AromaticContact CZ-CG 3.14Å; F82-H91 AromaticContact CZ-ND1 3.67Å; F82-H91 AromaticContact CZ-NE2 3.83Å; A87-H91 WeakPolarHBondContact O-CB 3.21Å; A87-H91 PolarHBondContact O-N 3.45Å; R88-H91 PolarHBondContact O-N 3.06Å; R89-H91 VanDerWaalsContact C-N 3.27Å; R89-H91 PolarHBondContact O-N 2.79Å; H91-R93 PolarHBondContact O-N 3.02Å; H91-R93 VanDerWaalsContact O-N 3.13Å; H91-I94 VanDerWaalsContact O-CB 3.23Å; H91-I94 WeakPolarHBondContact O-CB 3.47Å; H91-I94 WeakPolarHBondContact O-CG1 3.5Å; H91-I94 PolarHBondContact O-N 2.94Å; H91-H95 AromaticContact CE1-NE2 3.48Å; H91-H95 PolarHBondContact CE1-NE2 3.06Å; H91-H95 AromaticContact NE2-CD2 3.69Å; H91-H95 AromaticContact NE2-NE2 3.25Å; H91-H95 PolarHBondContact NE2-NE2 3.08Å
92	A	59.3	Low	55.8	Low	22 Å²	22	69.5 Å²	69.5	18%	0.182	38%	0.375	C	S	.	.	H	α-helix	trans	-54.8	-34.8	178.8	0	0	0	0	0	112.3	R88 R89 I94 H95 E96	R88-A92 PolarHBondContact O-N 3.43Å; R89-A92 PolarHBondContact O-N 2.93Å; A92-I94 PolarHBondContact O-N 3.27Å; A92-I94 VanDerWaalsContact O-N 3.12Å; A92-H95 WeakPolarHBondContact O-CB 3.47Å; A92-H95 PolarHBondContact O-N 2.96Å; A92-E96 PolarHBondContact O-N 3.49Å
93	R	58.5	Low	57	Low	92 Å²	92	67.5 Å²	67.5	35%	0.347	37%	0.366	S	S	.	.	H	α-helix	trans	-56.4	-24.2	172.9	-68.6	-173.8	-65.1	-163.2	1.5	114.8	R89 H91 H95 E96 N97 Q98 A99	R89-R93 PolarHBondContact O-N 3.28Å; H91-R93 PolarHBondContact O-N 3.02Å; H91-R93 VanDerWaalsContact O-N 3.13Å; R93-H95 VanDerWaalsContact C-N 3.34Å; R93-E96 PolarHBondContact O-N 3.39Å; R93-N97 PolarHBondContact O-N 3.28Å; R93-Q98 HydrophobicContact CB-CB 4.08Å; R93-Q98 HydrophobicContact CG-CB 4.29Å; R93-Q98 CarbonylContact O-C 3.44Å; R93-Q98 WeakPolarHBondContact O-CA 3.23Å; R93-Q98 PolarHBondContact O-N 3.49Å; R93-A99 PolarHBondContact O-N 3.5Å
94	I	53	Low	58.1	Low	46 Å²	46	67.5 Å²	67.5	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-66.3	-38.5	174	-60.4	175.5	0	0	0	110.3	H91 A92 N97 A99 Q109 T111	H91-I94 VanDerWaalsContact O-CB 3.23Å; H91-I94 WeakPolarHBondContact O-CB 3.47Å; H91-I94 WeakPolarHBondContact O-CG1 3.5Å; H91-I94 PolarHBondContact O-N 2.94Å; A92-I94 PolarHBondContact O-N 3.27Å; A92-I94 VanDerWaalsContact O-N 3.12Å; I94-N97 PolarHBondContact O-N 2.82Å; I94-A99 HydrophobicContact CG1-CB 4.28Å; I94-Q109 HydrophobicContact CG1-CB 4.38Å; I94-Q109 HydrophobicContact CG2-CB 4.08Å; I94-Q109 PolarHBondContact O-OE1 3.06Å; I94-T111 HydrophobicContact CD1-CG2 4.23Å
95	H	55.4	Low	58.8	Low	63 Å²	63	70 Å²	70	29%	0.292	36%	0.363	S	S	.	.	H	α-helix	trans	-75.3	-27.2	176.5	-64	-62.7	0	0	0	113.1	C75 I77 H91 A92 R93 N97	C75-H95 PolarHBondContact SG-CD2 3.47Å; C75-H95 PolarHBondContact SG-NE2 2.83Å; C75-H95 VanDerWaalsContact SG-NE2 3.38Å; I77-H95 HydrophobicContact CD1-CB 3.55Å; I77-H95 HydrophobicContact CG2-CB 4.43Å; I77-H95 WeakPolarHBondContact CG2-ND1 3.46Å; H91-H95 AromaticContact CE1-NE2 3.48Å; H91-H95 PolarHBondContact CE1-NE2 3.06Å; H91-H95 AromaticContact NE2-CD2 3.69Å; H91-H95 AromaticContact NE2-NE2 3.25Å; H91-H95 PolarHBondContact NE2-NE2 3.08Å; A92-H95 WeakPolarHBondContact O-CB 3.47Å; A92-H95 PolarHBondContact O-N 2.96Å; R93-H95 VanDerWaalsContact C-N 3.34Å; H95-N97 PolarHBondContact O-N 3.47Å
96	E	55.6	Low	58.8	Low	116 Å²	116	71.2 Å²	71.2	54%	0.542	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	2.2	175.8	-63.6	164.8	177.7	0	0	112.5	A92 R93 Q98	A92-E96 PolarHBondContact O-N 3.49Å; R93-E96 PolarHBondContact O-N 3.39Å; E96-Q98 HydrophobicContact CB-CB 4.44Å; E96-Q98 HydrophobicContact CB-CG 4.14Å; E96-Q98 PolarHBondContact O-N 3.49Å; E96-Q98 VanDerWaalsContact O-N 3.16Å
97	N	51.2	Low	58.9	Low	128 Å²	128	68.7 Å²	68.7	68%	0.684	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	22.6	-169.1	-63.8	-65.2	0	0	0	114.2	R93 I94 H95	R93-N97 PolarHBondContact O-N 3.28Å; I94-N97 PolarHBondContact O-N 2.82Å; H95-N97 PolarHBondContact O-N 3.47Å
98	Q	52.9	Low	59.3	Low	126 Å²	126	72 Å²	72	59%	0.589	37%	0.373	S	S	*	.			trans	-98.1	23.9	175.5	-62.2	-164.1	12.1	0	0	112.8	R93 E96 P100	R93-Q98 HydrophobicContact CB-CB 4.08Å; R93-Q98 HydrophobicContact CG-CB 4.29Å; R93-Q98 CarbonylContact O-C 3.44Å; R93-Q98 WeakPolarHBondContact O-CA 3.23Å; R93-Q98 PolarHBondContact O-N 3.49Å; E96-Q98 HydrophobicContact CB-CB 4.44Å; E96-Q98 HydrophobicContact CB-CG 4.14Å; E96-Q98 PolarHBondContact O-N 3.49Å; E96-Q98 VanDerWaalsContact O-N 3.16Å; Q98-P100 WeakPolarHBondContact O-CD 3.15Å
99	A	55.3	Low	59.7	Low	10 Å²	10	71.3 Å²	71.3	8%	0.083	37%	0.373	C	S	.	.			trans	-67.1	110.9	169.1	0	0	0	0	0	109	R93 I94 F101 Q109	R93-A99 PolarHBondContact O-N 3.5Å; I94-A99 HydrophobicContact CG1-CB 4.28Å; A99-F101 PolarHBondContact O-N 2.97Å; A99-F101 VanDerWaalsContact O-N 3.14Å; A99-Q109 HydrophobicContact CB-CB 3.66Å; A99-Q109 HydrophobicContact CB-CG 4.04Å
100	P	64	Low	59.9	Low	76 Å²	76	64.7 Å²	64.7	49%	0.494	35%	0.349	S	S	.	.	S	Bend	trans	-79.1	0.2	-170.2	26.3	-22.5	0	0	0	113.2	Q98	Q98-P100 WeakPolarHBondContact O-CD 3.15Å
101	F	66.6	Low	60.1	Low	65 Å²	65	65.5 Å²	65.5	29%	0.285	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	86.7	-177.3	-55.7	-74.3	0	0	0	109	A99 F110 N112 G113 R116	A99-F101 PolarHBondContact O-N 2.97Å; A99-F101 VanDerWaalsContact O-N 3.14Å; F101-F110 HydrophobicContact CB-CB 4.17Å; F101-F110 WeakPolarHBondContact O-CA 3.35Å; F101-F110 WeakPolarHBondContact O-CB 3.15Å; F101-F110 WeakPolarHBondContact O-CD2 3.37Å; F101-F110 PolarHBondContact O-N 3.1Å; F101-N112 VanDerWaalsContact CD2-CA 3.45Å; F101-G113 VanDerWaalsContact CD1-CA 3.45Å; F101-G113 VanDerWaalsContact CE2-N 3.3Å; F101-R116 HydrophobicContact CB-CB 4.04Å
102	V	67.4	Low	60.7	Low	68 Å²	68	67 Å²	67	41%	0.412	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	143.8	172.7	-170.5	0	0	0	0	108.7	E108 Q109	V102-E108 CarbonylContact C-O 3.6Å; V102-E108 WeakPolarHBondContact CA-O 3.46Å; V102-Q109 HydrophobicContact CG2-CG 4.41Å
103	C	66.1	Low	61.4	Low	1 Å²	1	66.5 Å²	66.5	1%	0.007	36%	0.357	C	S	.	.			trans	-71.6	122.3	164.9	173.5	0	0	0	0	109.6	E105 C106 G107 E108 F110 H119 M120	C103-E105 PolarHBondContact O-N 3.03Å; C103-E105 PolarHBondContact SG-N 3.3Å; C103-E105 VanDerWaalsContact SG-N 3.35Å; C103-C106 PolarHBondContact SG-N 3.07Å; C103-C106 VanDerWaalsContact SG-SG 3.62Å; C103-G107 WeakPolarHBondContact O-CA 3.32Å; C103-G107 PolarHBondContact O-N 3.02Å; C103-E108 PolarHBondContact N-O 2.77Å; C103-F110 HydrophobicContact CB-CE2 4.02Å; C103-H119 VanDerWaalsContact CB-NE2 3.31Å; C103-H119 WeakPolarHBondContact CB-NE2 3.3Å; C103-H119 PolarHBondContact SG-NE2 2.84Å; C103-M120 HydrophobicContact CB-SD 4.3Å
104	P	66.9	Low	62.1	Low	101 Å²	101	68.1 Å²	68.1	66%	0.656	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-19.2	179.4	27.8	-35.5	0	0	0	113.9	M120	P104-M120 HydrophobicContact CG-CE 4.04Å; P104-M120 HydrophobicContact CG-SD 4.34Å
105	E	60.5	Low	62.5	Low	108 Å²	108	70.7 Å²	70.7	51%	0.505	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-29.1	-173.5	-70.2	-179.4	-129	0	0	114.6	C103 M120 H123	C103-E105 PolarHBondContact O-N 3.03Å; C103-E105 PolarHBondContact SG-N 3.3Å; C103-E105 VanDerWaalsContact SG-N 3.35Å; E105-M120 HydrophobicContact CG-CE 4.41Å; E105-M120 WeakPolarHBondContact OE1-CE 3.46Å; E105-H123 WeakPolarHBondContact CB-CE1 3.41Å; E105-H123 WeakPolarHBondContact CB-ND1 3.45Å; E105-H123 WeakPolarHBondContact OE2-CB 3.35Å; E105-H123 IonicContact OE2-CE1 2.7Å; E105-H123 IonicContact OE2-CG 3.1Å; E105-H123 IonicContact OE2-ND1 2.93Å; E105-H123 PolarHBondContact OE2-ND1 3.21Å
106	C	57.1	Low	63.3	Low	70 Å²	70	71.1 Å²	71.1	47%	0.473	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-7.6	177	73.4	0	0	0	0	115	C103 E108 H119	C103-C106 PolarHBondContact SG-N 3.07Å; C103-C106 VanDerWaalsContact SG-SG 3.62Å; C106-E108 VanDerWaalsContact C-N 3.27Å; C106-E108 PolarHBondContact O-N 3.1Å; C106-E108 VanDerWaalsContact SG-CB 3.59Å; C106-E108 PolarHBondContact SG-N 3.35Å; C106-H119 PolarHBondContact SG-CE1 3.39Å; C106-H119 PolarHBondContact SG-NE2 2.84Å
107	G	61.3	Low	64.1	Low	42 Å²	42	69.1 Å²	69.1	43%	0.433	37%	0.37	S	S	.	.			trans	75.6	3.7	-178.3	0	0	0	0	0	115.7	C103	C103-G107 WeakPolarHBondContact O-CA 3.32Å; C103-G107 PolarHBondContact O-N 3.02Å
108	E	57.5	Low	64.7	Low	105 Å²	105	68.2 Å²	68.2	49%	0.491	36%	0.362	S	S	.	.			trans	-61.4	137.7	176.8	-169.3	175.3	-169.8	0	0	111	V102 C103 C106 F110 H119	V102-E108 CarbonylContact C-O 3.6Å; V102-E108 WeakPolarHBondContact CA-O 3.46Å; C103-E108 PolarHBondContact N-O 2.77Å; C106-E108 VanDerWaalsContact C-N 3.27Å; C106-E108 PolarHBondContact O-N 3.1Å; C106-E108 VanDerWaalsContact SG-CB 3.59Å; C106-E108 PolarHBondContact SG-N 3.35Å; E108-F110 HydrophobicContact CB-CE2 3.79Å; E108-F110 HydrophobicContact CB-CZ 3.78Å; E108-F110 VanDerWaalsContact CD-CZ 3.49Å; E108-F110 HydrophobicContact CG-CE1 4.17Å; E108-F110 HydrophobicContact CG-CE2 3.93Å; E108-F110 HydrophobicContact CG-CZ 3.52Å; E108-F110 WeakPolarHBondContact O-CD2 3.33Å; E108-F110 VanDerWaalsContact O-CE2 3.25Å; E108-F110 WeakPolarHBondContact O-CE2 3.4Å; E108-F110 WeakPolarHBondContact OE2-CZ 3.42Å; E108-H119 IonicContact OE2-CE1 3.19Å; E108-H119 PolarHBondContact OE2-CE1 3.29Å; E108-H119 IonicContact OE2-ND1 2.85Å; E108-H119 PolarHBondContact OE2-ND1 3.33Å; E108-H119 VanDerWaalsContact OE2-ND1 3.1Å
109	Q	65.4	Low	65.3	Low	55 Å²	55	63.1 Å²	63.1	26%	0.257	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.5	-169.6	-69.4	-165.8	22.4	0	0	112.2	I94 A99 V102	I94-Q109 HydrophobicContact CG1-CB 4.38Å; I94-Q109 HydrophobicContact CG2-CB 4.08Å; I94-Q109 PolarHBondContact O-OE1 3.06Å; A99-Q109 HydrophobicContact CB-CB 3.66Å; A99-Q109 HydrophobicContact CB-CG 4.04Å; V102-Q109 HydrophobicContact CG2-CG 4.41Å
110	F	65.3	Low	65.7	Low	21 Å²	21	63.6 Å²	63.6	9%	0.092	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	145.7	-173.9	-61	-80.9	0	0	0	114	F101 C103 E108 N112 K115 R116 H119	F101-F110 HydrophobicContact CB-CB 4.17Å; F101-F110 WeakPolarHBondContact O-CA 3.35Å; F101-F110 WeakPolarHBondContact O-CB 3.15Å; F101-F110 WeakPolarHBondContact O-CD2 3.37Å; F101-F110 PolarHBondContact O-N 3.1Å; C103-F110 HydrophobicContact CB-CE2 4.02Å; E108-F110 HydrophobicContact CB-CE2 3.79Å; E108-F110 HydrophobicContact CB-CZ 3.78Å; E108-F110 VanDerWaalsContact CD-CZ 3.49Å; E108-F110 HydrophobicContact CG-CE1 4.17Å; E108-F110 HydrophobicContact CG-CE2 3.93Å; E108-F110 HydrophobicContact CG-CZ 3.52Å; E108-F110 WeakPolarHBondContact O-CD2 3.33Å; E108-F110 VanDerWaalsContact O-CE2 3.25Å; E108-F110 WeakPolarHBondContact O-CE2 3.4Å; E108-F110 WeakPolarHBondContact OE2-CZ 3.42Å; F110-N112 VanDerWaalsContact C-N 3.34Å; F110-N112 PolarHBondContact O-N 3.34Å; F110-K115 HydrophobicContact CB-CB 4.29Å; F110-K115 HydrophobicContact CD1-CB 3.77Å; F110-K115 HydrophobicContact CG-CB 4.33Å; F110-R116 HydrophobicContact CB-CB 4.02Å; F110-R116 HydrophobicContact CD2-CB 3.64Å; F110-R116 HydrophobicContact CD2-CG 4.13Å; F110-R116 HydrophobicContact CE2-CB 4.43Å; F110-R116 HydrophobicContact CG-CB 3.9Å; F110-H119 HydrophobicContact CE1-CB 3.94Å; F110-H119 HydrophobicContact CE2-CB 4.15Å; F110-H119 AromaticContact CE2-CD2 3.84Å; F110-H119 AromaticContact CE2-CG 3.84Å; F110-H119 HydrophobicContact CZ-CB 3.55Å; F110-H119 AromaticContact CZ-CD2 3.81Å; F110-H119 AromaticContact CZ-CE1 3.88Å; F110-H119 AromaticContact CZ-CG 3.33Å; F110-H119 AromaticContact CZ-ND1 3.4Å; F110-H119 WeakPolarHBondContact CZ-ND1 3.25Å
111	T	62.6	Low	65.5	Low	36 Å²	36	62.5 Å²	62.5	22%	0.221	33%	0.329	C	S	.	.	S	Bend	trans	-76.4	-17.9	-178.9	38.2	0	0	0	0	113.9	A90 I94 K115	A90-T111 HydrophobicContact CB-CG2 4.24Å; I94-T111 HydrophobicContact CD1-CG2 4.23Å; T111-K115 PolarHBondContact OG1-NZ 2.99Å
112	N	72.7	Confident	64.8	Low	57 Å²	57	64.1 Å²	64.1	31%	0.305	34%	0.339	S	S	.	.	S	Bend	trans	-157.1	159.1	174.1	64.4	-20.5	0	0	0	110.9	F101 F110 Q114 K115 R116	F101-N112 VanDerWaalsContact CD2-CA 3.45Å; F110-N112 VanDerWaalsContact C-N 3.34Å; F110-N112 PolarHBondContact O-N 3.34Å; N112-Q114 PolarHBondContact O-N 3.4Å; N112-K115 PolarHBondContact O-N 3.12Å; N112-K115 WeakPolarHBondContact OD1-CB 3.34Å; N112-K115 VanDerWaalsContact OD1-CD 3.23Å; N112-K115 WeakPolarHBondContact OD1-CD 3.48Å; N112-K115 WeakPolarHBondContact OD1-CG 3.49Å; N112-R116 PolarHBondContact O-N 2.93Å
113	G	74.4	Confident	64.4	Low	10 Å²	10	63.7 Å²	63.7	10%	0.103	33%	0.333	C	S	.	.	H	α-helix	trans	-56.3	-46.8	-177.7	0	0	0	0	0	113	F101 K115 R116 D117	F101-G113 VanDerWaalsContact CD1-CA 3.45Å; F101-G113 VanDerWaalsContact CE2-N 3.3Å; G113-K115 PolarHBondContact O-N 3.39Å; G113-R116 CarbonylContact O-C 3.53Å; G113-R116 WeakPolarHBondContact O-CA 3.36Å; G113-R116 WeakPolarHBondContact O-CB 3.39Å; G113-R116 PolarHBondContact O-N 2.92Å; G113-D117 VanDerWaalsContact C-OD2 3.27Å; G113-D117 PolarHBondContact O-N 3.28Å; G113-D117 VanDerWaalsContact O-OD2 3.06Å
114	Q	72.8	Confident	63.7	Low	126 Å²	126	68.8 Å²	68.8	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-51.8	-36.8	-179.8	-171.7	-176.8	12.9	0	0	114.2	N112 D117 Q118	N112-Q114 PolarHBondContact O-N 3.4Å; Q114-D117 PolarHBondContact O-N 3.17Å; Q114-Q118 WeakPolarHBondContact O-CB 3.43Å; Q114-Q118 VanDerWaalsContact O-CG 3.3Å; Q114-Q118 WeakPolarHBondContact O-CG 3.34Å; Q114-Q118 PolarHBondContact O-N 2.78Å
115	K	62.1	Low	62.8	Low	100 Å²	100	66.5 Å²	66.5	44%	0.435	35%	0.351	S	S	.	.	H	α-helix	trans	-74.6	-39.1	176.7	-73.4	175.5	-167.9	173.9	0	112.7	F110 T111 N112 G113 D117 H119	F110-K115 HydrophobicContact CB-CB 4.29Å; F110-K115 HydrophobicContact CD1-CB 3.77Å; F110-K115 HydrophobicContact CG-CB 4.33Å; T111-K115 PolarHBondContact OG1-NZ 2.99Å; N112-K115 PolarHBondContact O-N 3.12Å; N112-K115 WeakPolarHBondContact OD1-CB 3.34Å; N112-K115 VanDerWaalsContact OD1-CD 3.23Å; N112-K115 WeakPolarHBondContact OD1-CD 3.48Å; N112-K115 WeakPolarHBondContact OD1-CG 3.49Å; G113-K115 PolarHBondContact O-N 3.39Å; K115-D117 VanDerWaalsContact C-N 3.28Å; K115-H119 WeakPolarHBondContact O-CB 3.38Å; K115-H119 PolarHBondContact O-N 2.86Å
116	R	72.7	Confident	61.8	Low	73 Å²	73	67.8 Å²	67.8	28%	0.275	36%	0.357	S	S	.	.	H	α-helix	trans	-57.4	-47.1	169.3	175	-154.4	61.9	-169.8	-6.5	109.2	F101 F110 N112 G113 Q118 H119 M120	F101-R116 HydrophobicContact CB-CB 4.04Å; F110-R116 HydrophobicContact CB-CB 4.02Å; F110-R116 HydrophobicContact CD2-CB 3.64Å; F110-R116 HydrophobicContact CD2-CG 4.13Å; F110-R116 HydrophobicContact CE2-CB 4.43Å; F110-R116 HydrophobicContact CG-CB 3.9Å; N112-R116 PolarHBondContact O-N 2.93Å; G113-R116 CarbonylContact O-C 3.53Å; G113-R116 WeakPolarHBondContact O-CA 3.36Å; G113-R116 WeakPolarHBondContact O-CB 3.39Å; G113-R116 PolarHBondContact O-N 2.92Å; R116-Q118 PolarHBondContact O-N 3.38Å; R116-H119 CarbonylContact O-C 3.06Å; R116-H119 WeakPolarHBondContact O-CA 3.38Å; R116-H119 WeakPolarHBondContact O-CB 3.17Å; R116-H119 PolarHBondContact O-N 3.44Å; R116-M120 HydrophobicContact CG-CG 4.35Å; R116-M120 WeakPolarHBondContact O-CG 3.47Å; R116-M120 PolarHBondContact O-N 3.25Å
117	D	71.9	Confident	61	Low	73 Å²	73	75.3 Å²	75.3	39%	0.39	38%	0.376	S	S	.	.	H	α-helix	trans	-66.7	-40	-175.2	-56.6	-26.5	0	0	0	111.5	G113 Q114 K115 H119 M120	G113-D117 VanDerWaalsContact C-OD2 3.27Å; G113-D117 PolarHBondContact O-N 3.28Å; G113-D117 VanDerWaalsContact O-OD2 3.06Å; Q114-D117 PolarHBondContact O-N 3.17Å; K115-D117 VanDerWaalsContact C-N 3.28Å; D117-H119 VanDerWaalsContact C-N 3.33Å; D117-H119 PolarHBondContact O-N 3.02Å; D117-M120 PolarHBondContact O-N 3.39Å
118	Q	63.2	Low	59.7	Low	109 Å²	109	80.5 Å²	80.5	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-63.1	-36.7	169.8	-75.9	175.6	-28.5	0	0	112.9	Q114 R116 L121	Q114-Q118 WeakPolarHBondContact O-CB 3.43Å; Q114-Q118 VanDerWaalsContact O-CG 3.3Å; Q114-Q118 WeakPolarHBondContact O-CG 3.34Å; Q114-Q118 PolarHBondContact O-N 2.78Å; R116-Q118 PolarHBondContact O-N 3.38Å; Q118-L121 WeakPolarHBondContact O-CB 3.43Å
119	H	64.9	Low	58.5	Low	19 Å²	19	81.6 Å²	81.6	9%	0.088	40%	0.396	C	S	.	.	H	α-helix	trans	-71	-33.7	173.9	164.7	106.1	0	0	0	112.5	C103 C106 E108 F110 K115 R116 D117 L121 I122 H123	C103-H119 VanDerWaalsContact CB-NE2 3.31Å; C103-H119 WeakPolarHBondContact CB-NE2 3.3Å; C103-H119 PolarHBondContact SG-NE2 2.84Å; C106-H119 PolarHBondContact SG-CE1 3.39Å; C106-H119 PolarHBondContact SG-NE2 2.84Å; E108-H119 IonicContact OE2-CE1 3.19Å; E108-H119 PolarHBondContact OE2-CE1 3.29Å; E108-H119 IonicContact OE2-ND1 2.85Å; E108-H119 PolarHBondContact OE2-ND1 3.33Å; E108-H119 VanDerWaalsContact OE2-ND1 3.1Å; F110-H119 HydrophobicContact CE1-CB 3.94Å; F110-H119 HydrophobicContact CE2-CB 4.15Å; F110-H119 AromaticContact CE2-CD2 3.84Å; F110-H119 AromaticContact CE2-CG 3.84Å; F110-H119 HydrophobicContact CZ-CB 3.55Å; F110-H119 AromaticContact CZ-CD2 3.81Å; F110-H119 AromaticContact CZ-CE1 3.88Å; F110-H119 AromaticContact CZ-CG 3.33Å; F110-H119 AromaticContact CZ-ND1 3.4Å; F110-H119 WeakPolarHBondContact CZ-ND1 3.25Å; K115-H119 WeakPolarHBondContact O-CB 3.38Å; K115-H119 PolarHBondContact O-N 2.86Å; R116-H119 CarbonylContact O-C 3.06Å; R116-H119 WeakPolarHBondContact O-CA 3.38Å; R116-H119 WeakPolarHBondContact O-CB 3.17Å; R116-H119 PolarHBondContact O-N 3.44Å; D117-H119 VanDerWaalsContact C-N 3.33Å; D117-H119 PolarHBondContact O-N 3.02Å; H119-L121 PolarHBondContact O-N 3.32Å; H119-L121 VanDerWaalsContact O-N 3.16Å; H119-I122 VanDerWaalsContact O-CB 3.23Å; H119-I122 WeakPolarHBondContact O-CB 3.26Å; H119-I122 WeakPolarHBondContact O-CG1 3.23Å; H119-I122 PolarHBondContact O-N 3.41Å; H119-H123 AromaticContact CD2-CD2 3.82Å; H119-H123 AromaticContact CE1-NE2 3.92Å; H119-H123 AromaticContact NE2-CD2 3.4Å; H119-H123 PolarHBondContact NE2-CD2 2.91Å; H119-H123 AromaticContact NE2-NE2 3.34Å; H119-H123 PolarHBondContact NE2-NE2 3.04Å
120	M	64.8	Low	56.9	Low	21 Å²	21	83.1 Å²	83.1	10%	0.103	41%	0.409	C	S	.	.	H	α-helix	trans	-61	-23.9	175.5	-67.6	-46.5	-58.8	0	0	112.7	C103 P104 E105 R116 D117 I122 H123 Q124	C103-M120 HydrophobicContact CB-SD 4.3Å; P104-M120 HydrophobicContact CG-CE 4.04Å; P104-M120 HydrophobicContact CG-SD 4.34Å; E105-M120 HydrophobicContact CG-CE 4.41Å; E105-M120 WeakPolarHBondContact OE1-CE 3.46Å; R116-M120 HydrophobicContact CG-CG 4.35Å; R116-M120 WeakPolarHBondContact O-CG 3.47Å; R116-M120 PolarHBondContact O-N 3.25Å; D117-M120 PolarHBondContact O-N 3.39Å; M120-I122 PolarHBondContact O-N 3.29Å; M120-H123 HydrophobicContact CE-CB 4.03Å; M120-H123 WeakPolarHBondContact O-CA 3.26Å; M120-H123 WeakPolarHBondContact O-CB 3.12Å; M120-H123 PolarHBondContact O-N 2.84Å; M120-Q124 WeakPolarHBondContact O-CB 3.22Å; M120-Q124 WeakPolarHBondContact O-CG 3.23Å; M120-Q124 PolarHBondContact O-N 3.46Å
121	L	60.5	Low	55.9	Low	53 Å²	53	84.4 Å²	84.4	28%	0.277	42%	0.418	S	S	.	.	H	α-helix	trans	-65.6	-23.1	173.8	-55.6	178.3	0	0	0	113	Q118 H119 H123 T130	Q118-L121 WeakPolarHBondContact O-CB 3.43Å; H119-L121 PolarHBondContact O-N 3.32Å; H119-L121 VanDerWaalsContact O-N 3.16Å; L121-H123 VanDerWaalsContact C-N 3.32Å; L121-T130 HydrophobicContact CD1-CG2 3.72Å; L121-T130 WeakPolarHBondContact CD1-OG1 3.42Å
122	I	51.5	Low	55.3	Low	99 Å²	99	84.8 Å²	84.8	51%	0.508	43%	0.425	S	S	.	.	H	α-helix	trans	-68.9	-37.5	171.7	-53.3	170.9	0	0	0	109.9	H119 M120	H119-I122 VanDerWaalsContact O-CB 3.23Å; H119-I122 WeakPolarHBondContact O-CB 3.26Å; H119-I122 WeakPolarHBondContact O-CG1 3.23Å; H119-I122 PolarHBondContact O-N 3.41Å; M120-I122 PolarHBondContact O-N 3.29Å
123	H	59	Low	54.9	Low	58 Å²	58	86.1 Å²	86.1	27%	0.269	43%	0.426	S	S	.	.	H	α-helix	trans	-81.1	-46.7	-175.9	-84.1	-80	0	0	0	113.1	E105 H119 M120 L121 G125	E105-H123 WeakPolarHBondContact CB-CE1 3.41Å; E105-H123 WeakPolarHBondContact CB-ND1 3.45Å; E105-H123 WeakPolarHBondContact OE2-CB 3.35Å; E105-H123 IonicContact OE2-CE1 2.7Å; E105-H123 IonicContact OE2-CG 3.1Å; E105-H123 IonicContact OE2-ND1 2.93Å; E105-H123 PolarHBondContact OE2-ND1 3.21Å; H119-H123 AromaticContact CD2-CD2 3.82Å; H119-H123 AromaticContact CE1-NE2 3.92Å; H119-H123 AromaticContact NE2-CD2 3.4Å; H119-H123 PolarHBondContact NE2-CD2 2.91Å; H119-H123 AromaticContact NE2-NE2 3.34Å; H119-H123 PolarHBondContact NE2-NE2 3.04Å; M120-H123 HydrophobicContact CE-CB 4.03Å; M120-H123 WeakPolarHBondContact O-CA 3.26Å; M120-H123 WeakPolarHBondContact O-CB 3.12Å; M120-H123 PolarHBondContact O-N 2.84Å; L121-H123 VanDerWaalsContact C-N 3.32Å; H123-G125 PolarHBondContact O-N 3.45Å; H123-G125 VanDerWaalsContact O-N 3.12Å
124	Q	51.5	Low	54.2	Low	109 Å²	109	87.3 Å²	87.3	51%	0.509	43%	0.43	S	S	.	.	S	Bend	trans	-68	-12.7	-175.9	-70.1	170.8	-34.2	0	0	113.8	M120 E126	M120-Q124 WeakPolarHBondContact O-CB 3.22Å; M120-Q124 WeakPolarHBondContact O-CG 3.23Å; M120-Q124 PolarHBondContact O-N 3.46Å; Q124-E126 HydrophobicContact CB-CG 4.26Å; Q124-E126 PolarHBondContact O-N 3.48Å
125	G	46.3	Very low	54	Low	52 Å²	52	81.3 Å²	81.3	54%	0.536	40%	0.401	S	S	.	.			trans	66.6	1.4	179.6	0	0	0	0	0	114.9	H123 R127	H123-G125 PolarHBondContact O-N 3.45Å; H123-G125 VanDerWaalsContact O-N 3.12Å; G125-R127 PolarHBondContact O-N 3.01Å; G125-R127 VanDerWaalsContact O-N 3.17Å
126	E	39.5	Very low	53.9	Low	136 Å²	136	77.8 Å²	77.8	64%	0.636	39%	0.389	S	S	*	.			trans	-65.5	115.1	-175.4	-71.2	-161.8	154.1	0	0	111.6	Q124 W128	Q124-E126 HydrophobicContact CB-CG 4.26Å; Q124-E126 PolarHBondContact O-N 3.48Å; E126-W128 PolarHBondContact O-N 2.82Å
127	R	40.5	Very low	53.3	Low	228 Å²	228	75.3 Å²	75.3	86%	0.86	38%	0.382	S	S	*	.			trans	1.4	74.9	164.1	-86	-175.6	157.9	125.6	-4.2	116.4	G125 V129	G125-R127 PolarHBondContact O-N 3.01Å; G125-R127 VanDerWaalsContact O-N 3.17Å; R127-V129 WeakPolarHBondContact O-CG2 3.49Å; R127-V129 PolarHBondContact O-N 2.98Å
128	W	35.3	Very low	52.9	Low	150 Å²	150	74 Å²	74	57%	0.568	38%	0.378	S	S	*	.	S	Bend		53.7	13.2	112.4	-68.8	55.6	0	0	0	118.8	E126 V131	E126-W128 PolarHBondContact O-N 2.82Å; W128-V131 HydrophobicContact CB-CG2 4.11Å; W128-V131 HydrophobicContact CG-CG2 4.31Å
129	V	32	Very low	52.7	Low	128 Å²	128	72.3 Å²	72.3	78%	0.776	37%	0.367	S	S	*	.	S	Bend	trans	-93.8	-23.3	175.4	175.9	0	0	0	0	111.4	R127	R127-V129 WeakPolarHBondContact O-CG2 3.49Å; R127-V129 PolarHBondContact O-N 2.98Å
130	T	32.4	Very low	52.3	Low	87 Å²	87	77.2 Å²	77.2	53%	0.534	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-90.7	-8.4	177.8	51.2	0	0	0	0	114.4	L121 A132	L121-T130 HydrophobicContact CD1-CG2 3.72Å; L121-T130 WeakPolarHBondContact CD1-OG1 3.42Å; T130-A132 PolarHBondContact O-N 3.15Å
131	V	43.5	Very low	51.9	Low	48 Å²	48	81.3 Å²	81.3	29%	0.291	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-68.9	-9.9	176.4	-139.3	0	0	0	0	113.2	W128 W133 M134	W128-V131 HydrophobicContact CB-CG2 4.11Å; W128-V131 HydrophobicContact CG-CG2 4.31Å; V131-W133 PolarHBondContact O-N 2.9Å; V131-M134 HydrophobicContact CG1-CB 4.28Å; V131-M134 HydrophobicContact CG1-CE 4.09Å; V131-M134 PolarHBondContact O-N 2.65Å; V131-M134 VanDerWaalsContact O-N 3.09Å
132	A	50.9	Low	52.2	Low	45 Å²	45	81.6 Å²	81.6	37%	0.372	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-46.6	-35	-175.8	0	0	0	0	0	113.7	T130	T130-A132 PolarHBondContact O-N 3.15Å
133	W	63.6	Low	52.6	Low	85 Å²	85	82.7 Å²	82.7	32%	0.322	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-108.2	24.3	-172.7	-44.7	136.4	0	0	0	114.3	V131 Y142 N144 T145 L148	V131-W133 PolarHBondContact O-N 2.9Å; W133-Y142 WeakPolarHBondContact CB-O 3.48Å; W133-Y142 PolarHBondContact O-N 3.48Å; W133-N144 VanDerWaalsContact CD2-C 3.41Å; W133-T145 VanDerWaalsContact CE3-CA 3.48Å; W133-T145 HydrophobicContact CE3-CG2 4.42Å; W133-T145 HydrophobicContact CH2-CG2 3.86Å; W133-T145 WeakPolarHBondContact CH2-OG1 3.11Å; W133-T145 VanDerWaalsContact CZ3-CA 3.47Å; W133-T145 HydrophobicContact CZ3-CG2 3.58Å; W133-L148 HydrophobicContact CE3-CD2 4.49Å
134	M	59.8	Low	53.1	Low	35 Å²	35	82.1 Å²	82.1	17%	0.172	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-86.4	135.3	169.1	-175.9	-165.1	-78	0	0	111.5	V131 P136 Y139 H141	V131-M134 HydrophobicContact CG1-CB 4.28Å; V131-M134 HydrophobicContact CG1-CE 4.09Å; V131-M134 PolarHBondContact O-N 2.65Å; V131-M134 VanDerWaalsContact O-N 3.09Å; M134-P136 WeakPolarHBondContact O-CD 3.43Å; M134-Y139 HydrophobicContact SD-CD1 4.13Å; M134-H141 VanDerWaalsContact CE-NE2 3.25Å; M134-H141 WeakPolarHBondContact CE-NE2 3.43Å
135	C	67.3	Low	54.4	Low	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.401	C	S	.	.			trans	-70.4	123.2	172.4	176.5	0	0	0	0	112.8	V137 C138 Y139 K140 Y142 L148 H151 H156	C135-V137 PolarHBondContact O-N 3.1Å; C135-V137 VanDerWaalsContact O-N 3.14Å; C135-V137 PolarHBondContact SG-N 2.58Å; C135-C138 PolarHBondContact SG-N 3Å; C135-Y139 WeakPolarHBondContact O-CA 3.47Å; C135-Y139 WeakPolarHBondContact O-CD1 3.25Å; C135-Y139 PolarHBondContact O-N 3.35Å; C135-K140 PolarHBondContact N-O 3.3Å; C135-Y142 HydrophobicContact CB-CE2 4.28Å; C135-L148 HydrophobicContact CB-CD1 3.83Å; C135-H151 WeakPolarHBondContact CB-NE2 3.25Å; C135-H151 PolarHBondContact SG-NE2 2.68Å; C135-H156 PolarHBondContact SG-CD2 2.94Å; C135-H156 PolarHBondContact SG-NE2 2.86Å; C135-H156 VanDerWaalsContact SG-NE2 3.44Å
136	P	61.5	Low	56.1	Low	26 Å²	26	81.8 Å²	81.8	17%	0.169	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-3.5	178.9	29.1	-36.5	0	0	0	115.2	M134 Y139 L152 I200 L221	M134-P136 WeakPolarHBondContact O-CD 3.43Å; P136-Y139 WeakPolarHBondContact O-CE1 3.13Å; P136-L152 HydrophobicContact CG-CD2 4.38Å; P136-I200 HydrophobicContact CG-CD1 4.32Å; P136-L221 HydrophobicContact CG-CD2 4.47Å
137	V	60.6	Low	58	Low	21 Å²	21	80.2 Å²	80.2	13%	0.127	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-35.5	-177	-172.5	0	0	0	0	113.3	C135 H156 I200	C135-V137 PolarHBondContact O-N 3.1Å; C135-V137 VanDerWaalsContact O-N 3.14Å; C135-V137 PolarHBondContact SG-N 2.58Å; V137-H156 HydrophobicContact CG2-CB 4.4Å; V137-I200 HydrophobicContact CG2-CB 4.27Å; V137-I200 HydrophobicContact CG2-CG1 3.58Å
138	C	62	Low	59.8	Low	46 Å²	46	69.4 Å²	69.4	31%	0.311	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	4.7	178.7	76.3	0	0	0	0	114.9	C135 K140 H151 H156	C135-C138 PolarHBondContact SG-N 3Å; C138-K140 PolarHBondContact O-N 3.01Å; C138-H151 VanDerWaalsContact SG-CE1 3.53Å; C138-H151 PolarHBondContact SG-NE2 3.26Å; C138-H156 PolarHBondContact SG-NE2 3.23Å
139	Y	58.9	Low	62.1	Low	72 Å²	72	63.1 Å²	63.1	28%	0.282	33%	0.332	S	S	.	.			trans	58.4	17.2	170.7	-39.2	-60.4	0	0	0	115.9	M134 C135 P136 C233 G234 R235	M134-Y139 HydrophobicContact SD-CD1 4.13Å; C135-Y139 WeakPolarHBondContact O-CA 3.47Å; C135-Y139 WeakPolarHBondContact O-CD1 3.25Å; C135-Y139 PolarHBondContact O-N 3.35Å; P136-Y139 WeakPolarHBondContact O-CE1 3.13Å; Y139-C233 WeakPolarHBondContact CE2-O 3.47Å; Y139-C233 PolarHBondContact OH-O 3.3Å; Y139-G234 VanDerWaalsContact CE1-CA 3.45Å; Y139-G234 VanDerWaalsContact CZ-CA 3.44Å; Y139-G234 VanDerWaalsContact OH-C 3.22Å; Y139-R235 PolarHBondContact OH-N 3.45Å
140	K	56.5	Low	64.6	Low	123 Å²	123	59.4 Å²	59.4	54%	0.535	31%	0.312	S	S	.	.			trans	-64.2	138.5	164.6	-70.4	-179.5	-179.3	-179.7	0	110.1	C135 C138 Y142	C135-K140 PolarHBondContact N-O 3.3Å; C138-K140 PolarHBondContact O-N 3.01Å; K140-Y142 HydrophobicContact CB-CE2 3.63Å; K140-Y142 WeakPolarHBondContact CB-OH 3.31Å; K140-Y142 WeakPolarHBondContact O-CD2 3.29Å; K140-Y142 WeakPolarHBondContact O-CE2 3.44Å
141	H	57.6	Low	66.9	Low	106 Å²	106	55.9 Å²	55.9	49%	0.491	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-94.1	140.7	177	-61.9	90.8	0	0	0	110.6	M134	M134-H141 VanDerWaalsContact CE-NE2 3.25Å; M134-H141 WeakPolarHBondContact CE-NE2 3.43Å
142	Y	67.1	Low	68.4	Low	60 Å²	60	53.6 Å²	53.6	24%	0.235	28%	0.276	C	S	.	.			trans	-122.6	165.1	177.2	-64.1	-84.6	0	0	0	110.4	W133 C135 K140 M147 L148 H151	W133-Y142 WeakPolarHBondContact CB-O 3.48Å; W133-Y142 PolarHBondContact O-N 3.48Å; C135-Y142 HydrophobicContact CB-CE2 4.28Å; K140-Y142 HydrophobicContact CB-CE2 3.63Å; K140-Y142 WeakPolarHBondContact CB-OH 3.31Å; K140-Y142 WeakPolarHBondContact O-CD2 3.29Å; K140-Y142 WeakPolarHBondContact O-CE2 3.44Å; Y142-M147 HydrophobicContact CD1-CB 3.84Å; Y142-M147 HydrophobicContact CG-CB 4.35Å; Y142-L148 HydrophobicContact CD2-CB 4.05Å; Y142-L148 HydrophobicContact CD2-CD1 3.97Å; Y142-L148 HydrophobicContact CE2-CD1 4.32Å; Y142-L148 HydrophobicContact CG-CB 4.16Å; Y142-H151 HydrophobicContact CE1-CB 3.93Å; Y142-H151 HydrophobicContact CE2-CB 4.11Å; Y142-H151 AromaticContact CE2-CD2 3.25Å; Y142-H151 WeakPolarHBondContact CE2-CD2 3.21Å; Y142-H151 AromaticContact CE2-CG 3.78Å; Y142-H151 AromaticContact CZ-CD2 3.4Å; Y142-H151 AromaticContact CZ-CG 3.43Å; Y142-H151 VanDerWaalsContact CZ-CG 3.43Å; Y142-H151 PolarHBondContact OH-CD2 3.48Å; Y142-H151 PolarHBondContact OH-ND1 3.47Å
143	N	59.4	Low	69.9	Low	121 Å²	121	52 Å²	52	65%	0.647	26%	0.261	S	S	*	.	S	Bend	trans	-92.4	-15.9	-176.6	59.4	-36.7	0	0	0	113.9
144	N	69.9	Low	70.5	Confident	46 Å²	46	52.5 Å²	52.5	25%	0.246	27%	0.27	C	S	.	.	S	Bend	trans	-155.2	175.7	176.6	71.7	-10.7	0	0	0	112.1	W133 D146 M147 L148	W133-N144 VanDerWaalsContact CD2-C 3.41Å; N144-D146 VanDerWaalsContact C-N 3.33Å; N144-D146 PolarHBondContact ND2-OD2 3.11Å; N144-D146 PolarHBondContact O-N 3.47Å; N144-D146 PolarHBondContact OD1-N 3.44Å; N144-M147 VanDerWaalsContact OD1-CB 3.29Å; N144-M147 WeakPolarHBondContact OD1-CB 3.25Å; N144-M147 WeakPolarHBondContact OD1-CG 3.36Å; N144-M147 PolarHBondContact OD1-N 2.97Å; N144-L148 PolarHBondContact O-N 3.04Å
145	T	77.9	Confident	71.2	Confident	52 Å²	52	55 Å²	55	32%	0.319	29%	0.287	S	S	.	.	H	α-helix	trans	-49.3	-51.1	172.6	-23.3	0	0	0	0	112.1	W133 M147 L148 L149	W133-T145 VanDerWaalsContact CE3-CA 3.48Å; W133-T145 HydrophobicContact CE3-CG2 4.42Å; W133-T145 HydrophobicContact CH2-CG2 3.86Å; W133-T145 WeakPolarHBondContact CH2-OG1 3.11Å; W133-T145 VanDerWaalsContact CZ3-CA 3.47Å; W133-T145 HydrophobicContact CZ3-CG2 3.58Å; T145-M147 PolarHBondContact O-N 3.05Å; T145-L148 PolarHBondContact O-N 2.96Å; T145-L149 HydrophobicContact CG2-CD1 3.81Å; T145-L149 HydrophobicContact CG2-CG 4.44Å; T145-L149 WeakPolarHBondContact O-CB 3.21Å; T145-L149 WeakPolarHBondContact O-CG 3.26Å; T145-L149 PolarHBondContact O-N 2.71Å
146	D	82.1	Confident	71.6	Confident	103 Å²	103	55.6 Å²	55.6	55%	0.551	29%	0.29	S	S	*	.	H	α-helix	trans	-72	-35.7	-163.6	-47.8	-60	0	0	0	112	N144 L149 S150	N144-D146 VanDerWaalsContact C-N 3.33Å; N144-D146 PolarHBondContact ND2-OD2 3.11Å; N144-D146 PolarHBondContact O-N 3.47Å; N144-D146 PolarHBondContact OD1-N 3.44Å; D146-L149 PolarHBondContact O-N 2.85Å; D146-S150 WeakPolarHBondContact O-CB 3.3Å; D146-S150 PolarHBondContact O-N 2.94Å
147	M	79.1	Confident	72.2	Confident	103 Å²	103	55.7 Å²	55.7	51%	0.507	29%	0.29	S	S	.	.	H	α-helix	trans	-71.4	-35.4	176.2	-66	-69.9	159.6	0	0	111.6	Y142 N144 T145 H151	Y142-M147 HydrophobicContact CD1-CB 3.84Å; Y142-M147 HydrophobicContact CG-CB 4.35Å; N144-M147 VanDerWaalsContact OD1-CB 3.29Å; N144-M147 WeakPolarHBondContact OD1-CB 3.25Å; N144-M147 WeakPolarHBondContact OD1-CG 3.36Å; N144-M147 PolarHBondContact OD1-N 2.97Å; T145-M147 PolarHBondContact O-N 3.05Å; M147-H151 VanDerWaalsContact O-CB 3.24Å; M147-H151 WeakPolarHBondContact O-CB 3.47Å; M147-H151 PolarHBondContact O-N 3.01Å
148	L	78.7	Confident	73	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.8	-45.5	171	171.5	56.4	0	0	0	111.4	W133 C135 Y142 N144 T145 H151 L152 L221	W133-L148 HydrophobicContact CE3-CD2 4.49Å; C135-L148 HydrophobicContact CB-CD1 3.83Å; Y142-L148 HydrophobicContact CD2-CB 4.05Å; Y142-L148 HydrophobicContact CD2-CD1 3.97Å; Y142-L148 HydrophobicContact CE2-CD1 4.32Å; Y142-L148 HydrophobicContact CG-CB 4.16Å; N144-L148 PolarHBondContact O-N 3.04Å; T145-L148 PolarHBondContact O-N 2.96Å; L148-H151 WeakPolarHBondContact O-CB 3.5Å; L148-H151 PolarHBondContact O-N 3.26Å; L148-L152 HydrophobicContact CD1-CD1 3.92Å; L148-L152 HydrophobicContact CD1-CG 4.04Å; L148-L152 HydrophobicContact CG-CD1 4.05Å; L148-L152 WeakPolarHBondContact O-CG 3.32Å; L148-L152 PolarHBondContact O-N 3.36Å; L148-L221 HydrophobicContact CD2-CD1 3.66Å; L148-L221 HydrophobicContact CD2-CD2 3.72Å; L148-L221 HydrophobicContact CD2-CG 4.36Å; L148-L221 HydrophobicContact CG-CD1 4.04Å
149	L	84.2	Confident	73.8	Confident	18 Å²	18	60.5 Å²	60.5	9%	0.094	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-43	178.7	-73.2	171.8	0	0	0	111.9	T145 D146 L152 I153 F217 L221	T145-L149 HydrophobicContact CG2-CD1 3.81Å; T145-L149 HydrophobicContact CG2-CG 4.44Å; T145-L149 WeakPolarHBondContact O-CB 3.21Å; T145-L149 WeakPolarHBondContact O-CG 3.26Å; T145-L149 PolarHBondContact O-N 2.71Å; D146-L149 PolarHBondContact O-N 2.85Å; L149-L152 PolarHBondContact O-N 2.76Å; L149-I153 WeakPolarHBondContact O-CD1 3.18Å; L149-I153 VanDerWaalsContact O-CG1 3.24Å; L149-I153 WeakPolarHBondContact O-CG1 3.41Å; L149-I153 PolarHBondContact O-N 3.09Å; L149-F217 HydrophobicContact CD2-CB 3.71Å; L149-L221 HydrophobicContact CD2-CD1 3.89Å; L149-L221 HydrophobicContact CG-CD1 4.38Å
150	S	82.8	Confident	74.7	Confident	50 Å²	50	58.2 Å²	58.2	35%	0.35	30%	0.301	S	S	.	.	H	α-helix	trans	-60.6	-47.7	172.8	-154	0	0	0	0	110.2	D146 L152 I153 D154	D146-S150 WeakPolarHBondContact O-CB 3.3Å; D146-S150 PolarHBondContact O-N 2.94Å; S150-L152 VanDerWaalsContact C-N 3.34Å; S150-L152 PolarHBondContact O-N 2.57Å; S150-I153 CarbonylContact O-C 3.53Å; S150-I153 PolarHBondContact O-N 3.31Å; S150-D154 WeakPolarHBondContact O-CB 3.41Å; S150-D154 PolarHBondContact O-N 3Å; S150-D154 PolarHBondContact OG-OD2 3.16Å
151	H	80.9	Confident	75.9	Confident	13 Å²	13	54 Å²	54	6%	0.06	28%	0.282	C	S	.	.	H	α-helix	trans	-57.2	-42.3	176.7	164.6	49.9	0	0	0	113.5	C135 C138 Y142 M147 L148 I153 D154 V155 H156	C135-H151 WeakPolarHBondContact CB-NE2 3.25Å; C135-H151 PolarHBondContact SG-NE2 2.68Å; C138-H151 VanDerWaalsContact SG-CE1 3.53Å; C138-H151 PolarHBondContact SG-NE2 3.26Å; Y142-H151 HydrophobicContact CE1-CB 3.93Å; Y142-H151 HydrophobicContact CE2-CB 4.11Å; Y142-H151 AromaticContact CE2-CD2 3.25Å; Y142-H151 WeakPolarHBondContact CE2-CD2 3.21Å; Y142-H151 AromaticContact CE2-CG 3.78Å; Y142-H151 AromaticContact CZ-CD2 3.4Å; Y142-H151 AromaticContact CZ-CG 3.43Å; Y142-H151 VanDerWaalsContact CZ-CG 3.43Å; Y142-H151 PolarHBondContact OH-CD2 3.48Å; Y142-H151 PolarHBondContact OH-ND1 3.47Å; M147-H151 VanDerWaalsContact O-CB 3.24Å; M147-H151 WeakPolarHBondContact O-CB 3.47Å; M147-H151 PolarHBondContact O-N 3.01Å; L148-H151 WeakPolarHBondContact O-CB 3.5Å; L148-H151 PolarHBondContact O-N 3.26Å; H151-I153 VanDerWaalsContact C-N 3.31Å; H151-I153 PolarHBondContact O-N 3.16Å; H151-D154 PolarHBondContact O-N 2.94Å; H151-V155 WeakPolarHBondContact ND1-CG2 3.29Å; H151-V155 VanDerWaalsContact O-CB 3.3Å; H151-V155 WeakPolarHBondContact O-CB 3.47Å; H151-V155 PolarHBondContact O-N 3.42Å; H151-H156 AromaticContact CE1-CD2 3.57Å; H151-H156 AromaticContact CE1-NE2 3.27Å; H151-H156 PolarHBondContact CE1-NE2 3.16Å; H151-H156 VanDerWaalsContact CE1-NE2 3.27Å; H151-H156 AromaticContact NE2-CD2 3.48Å; H151-H156 PolarHBondContact NE2-CD2 3.08Å; H151-H156 AromaticContact NE2-NE2 3.29Å; H151-H156 PolarHBondContact NE2-NE2 3.49Å
152	L	76.6	Confident	77	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-40.5	175.3	-78.5	165.5	0	0	0	111.6	P136 L148 L149 S150 H156 T157 I200 F217 L221	P136-L152 HydrophobicContact CG-CD2 4.38Å; L148-L152 HydrophobicContact CD1-CD1 3.92Å; L148-L152 HydrophobicContact CD1-CG 4.04Å; L148-L152 HydrophobicContact CG-CD1 4.05Å; L148-L152 WeakPolarHBondContact O-CG 3.32Å; L148-L152 PolarHBondContact O-N 3.36Å; L149-L152 PolarHBondContact O-N 2.76Å; S150-L152 VanDerWaalsContact C-N 3.34Å; S150-L152 PolarHBondContact O-N 2.57Å; L152-H156 HydrophobicContact CD2-CB 4.17Å; L152-H156 CarbonylContact O-C 3.59Å; L152-H156 WeakPolarHBondContact O-CA 3.28Å; L152-H156 WeakPolarHBondContact O-CB 3.25Å; L152-H156 PolarHBondContact O-N 3.43Å; L152-T157 PolarHBondContact O-N 3.46Å; L152-T157 PolarHBondContact O-OG1 2.97Å; L152-I200 HydrophobicContact CD2-CD1 4.34Å; L152-F217 HydrophobicContact CB-CD1 3.85Å; L152-F217 HydrophobicContact CB-CD2 3.88Å; L152-F217 HydrophobicContact CB-CE1 3.94Å; L152-F217 HydrophobicContact CB-CE2 3.96Å; L152-F217 HydrophobicContact CB-CG 3.83Å; L152-F217 HydrophobicContact CB-CZ 4Å; L152-F217 HydrophobicContact CD1-CB 4.13Å; L152-F217 HydrophobicContact CD1-CD1 4.02Å; L152-F217 HydrophobicContact CD1-CG 4.16Å; L152-F217 HydrophobicContact CD2-CD1 4.12Å; L152-F217 HydrophobicContact CD2-CE1 4.07Å; L152-F217 HydrophobicContact CG-CD1 4.22Å; L152-F217 HydrophobicContact CG-CE1 4.47Å; L152-F217 HydrophobicContact CG-CG 4.5Å; L152-F217 WeakPolarHBondContact O-CZ 3.38Å; L152-L221 HydrophobicContact CD1-CD1 4.16Å; L152-L221 HydrophobicContact CD1-CD2 4.33Å; L152-L221 HydrophobicContact CD1-CG 4.4Å
153	I	80.6	Confident	77.7	Confident	13 Å²	13	46.6 Å²	46.6	7%	0.067	25%	0.251	C	S	.	.	H	α-helix	trans	-70.3	-45.3	177.4	-64.2	161.9	0	0	0	111.8	L149 S150 H151 T157 R210 L213 K214 F217	L149-I153 WeakPolarHBondContact O-CD1 3.18Å; L149-I153 VanDerWaalsContact O-CG1 3.24Å; L149-I153 WeakPolarHBondContact O-CG1 3.41Å; L149-I153 PolarHBondContact O-N 3.09Å; S150-I153 CarbonylContact O-C 3.53Å; S150-I153 PolarHBondContact O-N 3.31Å; H151-I153 VanDerWaalsContact C-N 3.31Å; H151-I153 PolarHBondContact O-N 3.16Å; I153-T157 WeakPolarHBondContact CA-OG1 3.26Å; I153-T157 VanDerWaalsContact O-CB 3.22Å; I153-T157 WeakPolarHBondContact O-CB 3.36Å; I153-T157 PolarHBondContact O-OG1 2.93Å; I153-T157 VanDerWaalsContact O-OG1 3.13Å; I153-R210 HydrophobicContact CG2-CG 4.33Å; I153-R210 VanDerWaalsContact CG2-NH2 3.34Å; I153-L213 HydrophobicContact CB-CD2 4.31Å; I153-L213 HydrophobicContact CG1-CD2 3.93Å; I153-L213 HydrophobicContact CG1-CG 4.23Å; I153-L213 HydrophobicContact CG2-CD2 3.79Å; I153-K214 HydrophobicContact CD1-CB 4.46Å; I153-K214 HydrophobicContact CD1-CG 3.48Å; I153-K214 VanDerWaalsContact CD1-CG 3.48Å; I153-F217 HydrophobicContact CB-CE2 4.49Å; I153-F217 HydrophobicContact CG1-CD2 3.74Å; I153-F217 HydrophobicContact CG1-CE2 3.78Å
154	D	76.9	Confident	78.8	Confident	95 Å²	95	45.9 Å²	45.9	51%	0.508	24%	0.243	S	C	.	.	H	α-helix	trans	-86	-17.1	-169.9	-57.6	-45	0	0	0	113.2	S150 H151 R210	S150-D154 WeakPolarHBondContact O-CB 3.41Å; S150-D154 PolarHBondContact O-N 3Å; S150-D154 PolarHBondContact OG-OD2 3.16Å; H151-D154 PolarHBondContact O-N 2.94Å; D154-R210 IonicContact OD1-CZ 2.74Å; D154-R210 IonicContact OD1-NH1 2.66Å; D154-R210 IonicContact OD1-NH2 3.14Å; D154-R210 PolarHBondContact OD1-NH2 3.37Å; D154-R210 IonicContact OD2-NH2 3.39Å
155	V	75.3	Confident	79.3	Confident	87 Å²	87	47.2 Å²	47.2	53%	0.527	25%	0.254	S	S	.	.	H	α-helix	trans	-127.7	-22.3	-176.8	-169.6	0	0	0	0	113.6	H151	H151-V155 WeakPolarHBondContact ND1-CG2 3.29Å; H151-V155 VanDerWaalsContact O-CB 3.3Å; H151-V155 WeakPolarHBondContact O-CB 3.47Å; H151-V155 PolarHBondContact O-N 3.42Å
156	H	75.6	Confident	79.6	Confident	12 Å²	12	47.6 Å²	47.6	6%	0.056	26%	0.258	C	S	.	.	S	Bend	trans	-124.2	30.5	-175.6	-60.6	-41.2	0	0	0	113.3	C135 V137 C138 H151 L152 G199	C135-H156 PolarHBondContact SG-CD2 2.94Å; C135-H156 PolarHBondContact SG-NE2 2.86Å; C135-H156 VanDerWaalsContact SG-NE2 3.44Å; V137-H156 HydrophobicContact CG2-CB 4.4Å; C138-H156 PolarHBondContact SG-NE2 3.23Å; H151-H156 AromaticContact CE1-CD2 3.57Å; H151-H156 AromaticContact CE1-NE2 3.27Å; H151-H156 PolarHBondContact CE1-NE2 3.16Å; H151-H156 VanDerWaalsContact CE1-NE2 3.27Å; H151-H156 AromaticContact NE2-CD2 3.48Å; H151-H156 PolarHBondContact NE2-CD2 3.08Å; H151-H156 AromaticContact NE2-NE2 3.29Å; H151-H156 PolarHBondContact NE2-NE2 3.49Å; L152-H156 HydrophobicContact CD2-CB 4.17Å; L152-H156 CarbonylContact O-C 3.59Å; L152-H156 WeakPolarHBondContact O-CA 3.28Å; L152-H156 WeakPolarHBondContact O-CB 3.25Å; L152-H156 PolarHBondContact O-N 3.43Å; H156-G199 WeakPolarHBondContact O-CA 3.18Å; H156-G199 PolarHBondContact O-N 3.29Å
157	T	74.3	Confident	79.6	Confident	29 Å²	29	47.1 Å²	47.1	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.8	168.2	-59.8	0	0	0	0	109.6	L152 I153 Y196 A197 L213 F217	L152-T157 PolarHBondContact O-N 3.46Å; L152-T157 PolarHBondContact O-OG1 2.97Å; I153-T157 WeakPolarHBondContact CA-OG1 3.26Å; I153-T157 VanDerWaalsContact O-CB 3.22Å; I153-T157 WeakPolarHBondContact O-CB 3.36Å; I153-T157 PolarHBondContact O-OG1 2.93Å; I153-T157 VanDerWaalsContact O-OG1 3.13Å; T157-Y196 HydrophobicContact CG2-CD1 3.97Å; T157-Y196 HydrophobicContact CG2-CG 4.32Å; T157-A197 WeakPolarHBondContact CA-O 3.4Å; T157-A197 WeakPolarHBondContact CG2-O 3.11Å; T157-L213 HydrophobicContact CG2-CD1 4.24Å; T157-L213 HydrophobicContact CG2-CD2 3.87Å; T157-F217 WeakPolarHBondContact OG1-CE2 3.31Å; T157-F217 WeakPolarHBondContact OG1-CZ 3.47Å
158	E	76.2	Confident	79.8	Confident	104 Å²	104	49.2 Å²	49.2	49%	0.486	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121	169.2	-173.8	179.3	177.8	0	0	108.9	L160 A197	E158-L160 HydrophobicContact CG-CD2 3.89Å; E158-L160 HydrophobicContact CG-CG 4.32Å; E158-L160 WeakPolarHBondContact OE1-CD2 2.98Å; E158-A197 HydrophobicContact CB-CB 4.33Å; E158-A197 PolarHBondContact N-O 3.35Å; E158-A197 PolarHBondContact O-N 3.4Å
159	L	78.6	Confident	79.8	Confident	64 Å²	64	52.3 Å²	52.3	34%	0.335	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	113.9	178.3	-175.2	59.7	0	0	0	110	Y161 L194 Y196	L159-Y161 HydrophobicContact CD2-CE1 4.48Å; L159-Y161 WeakPolarHBondContact CD2-OH 3.47Å; L159-Y161 HydrophobicContact CG-CE1 4.47Å; L159-Y161 HydrophobicContact CG-CE2 4.36Å; L159-Y161 WeakPolarHBondContact O-CE2 3.46Å; L159-L194 HydrophobicContact CD1-CB 4.21Å; L159-L194 HydrophobicContact CD1-CD1 4.49Å; L159-L194 HydrophobicContact CD1-CD2 4.23Å; L159-Y196 HydrophobicContact CD1-CD1 3.98Å; L159-Y196 HydrophobicContact CD1-CE1 3.87Å
160	L	78.2	Confident	79.5	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.12	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	145.5	-175.6	-62.1	178.2	0	0	0	111.1	E158 V169 H171 Y195 A197	E158-L160 HydrophobicContact CG-CD2 3.89Å; E158-L160 HydrophobicContact CG-CG 4.32Å; E158-L160 WeakPolarHBondContact OE1-CD2 2.98Å; L160-V169 HydrophobicContact CB-CG1 3.8Å; L160-V169 HydrophobicContact CD1-CG1 4.06Å; L160-V169 HydrophobicContact CG-CG1 4.36Å; L160-H171 HydrophobicContact CD2-CB 4.16Å; L160-Y195 PolarHBondContact N-O 3.07Å; L160-Y195 PolarHBondContact O-N 2.87Å; L160-A197 HydrophobicContact CD1-CB 3.83Å; L160-A197 HydrophobicContact CG-CB 4.44Å
161	Y	81.5	Confident	78.9	Confident	35 Å²	35	56.3 Å²	56.3	14%	0.137	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	113.5	-172.6	-55.9	-92	0	0	0	109.4	L159 V169 L170 V173 P192 L194	L159-Y161 HydrophobicContact CD2-CE1 4.48Å; L159-Y161 WeakPolarHBondContact CD2-OH 3.47Å; L159-Y161 HydrophobicContact CG-CE1 4.47Å; L159-Y161 HydrophobicContact CG-CE2 4.36Å; L159-Y161 WeakPolarHBondContact O-CE2 3.46Å; Y161-V169 CarbonylContact O-C 3.5Å; Y161-V169 WeakPolarHBondContact O-CA 2.92Å; Y161-L170 WeakPolarHBondContact CD2-O 3.17Å; Y161-L170 PolarHBondContact N-O 3.24Å; Y161-L170 PolarHBondContact O-N 3.43Å; Y161-V173 HydrophobicContact CD1-CG2 4.31Å; Y161-V173 HydrophobicContact CE1-CG2 3.55Å; Y161-V173 HydrophobicContact CE2-CG2 4.22Å; Y161-P192 HydrophobicContact CD1-CB 3.91Å; Y161-P192 HydrophobicContact CD1-CG 3.87Å; Y161-P192 HydrophobicContact CG-CB 4.48Å; Y161-L194 HydrophobicContact CD1-CD2 3.55Å; Y161-L194 HydrophobicContact CE1-CD2 3.57Å
162	S	80.6	Confident	78.6	Confident	10 Å²	10	57.6 Å²	57.6	7%	0.07	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.7	178.8	-175.5	0	0	0	0	111.6	T193	S162-T193 WeakPolarHBondContact CB-O 3.49Å; S162-T193 PolarHBondContact N-O 3.46Å; S162-T193 PolarHBondContact O-N 3.2Å; S162-T193 VanDerWaalsContact O-N 3.12Å
163	C	83	Confident	78.8	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.007	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	102.9	176.4	-174.5	0	0	0	0	111.5	C166 S167 R168 F176 H179 C180 H184	C163-C166 PolarHBondContact O-N 2.78Å; C163-C166 VanDerWaalsContact O-N 3.11Å; C163-S167 WeakPolarHBondContact O-CA 3.2Å; C163-S167 PolarHBondContact O-N 2.74Å; C163-R168 PolarHBondContact N-O 2.66Å; C163-F176 HydrophobicContact CB-CD2 4.3Å; C163-F176 HydrophobicContact CB-CE2 4.01Å; C163-H179 VanDerWaalsContact SG-CD2 3.55Å; C163-C180 VanDerWaalsContact SG-SG 3.62Å; C163-H184 PolarHBondContact SG-CD2 3Å; C163-H184 PolarHBondContact SG-NE2 2.97Å
164	E	81	Confident	78.9	Confident	106 Å²	106	63.9 Å²	63.9	50%	0.495	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-50.5	-44.9	-175	-59.3	-178	158.1	0	0	114.7	C166 T193	E164-C166 PolarHBondContact O-N 3.12Å; E164-T193 WeakPolarHBondContact CG-OG1 3.5Å; E164-T193 PolarHBondContact OE1-OG1 2.84Å
165	P	81.6	Confident	79.3	Confident	73 Å²	73	59.7 Å²	59.7	47%	0.474	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-61.4	-13.4	-180	-26.5	35.5	0	0	0	116.7
166	C	83.8	Confident	79.6	Confident	60 Å²	60	55.9 Å²	55.9	41%	0.405	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-149.2	10.5	-177.3	67.2	0	0	0	0	114.9	C163 E164 R168 H179 H184	C163-C166 PolarHBondContact O-N 2.78Å; C163-C166 VanDerWaalsContact O-N 3.11Å; E164-C166 PolarHBondContact O-N 3.12Å; C166-R168 PolarHBondContact O-N 2.9Å; C166-H179 PolarHBondContact SG-NE2 3.2Å; C166-H184 PolarHBondContact SG-NE2 2.96Å
167	S	81.5	Confident	80	Confident	94 Å²	94	59.4 Å²	59.4	66%	0.657	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	17.6	-177	-59.1	0	0	0	0	116.1	C163 V169	C163-S167 WeakPolarHBondContact O-CA 3.2Å; C163-S167 PolarHBondContact O-N 2.74Å; S167-V169 PolarHBondContact O-N 3.39Å
168	R	83.4	Confident	80.6	Confident	146 Å²	146	64.4 Å²	64.4	55%	0.551	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	119	-178.2	-170.4	179.2	-176.9	107.7	3.9	110.9	C163 C166 L170	C163-R168 PolarHBondContact N-O 2.66Å; C166-R168 PolarHBondContact O-N 2.9Å; R168-L170 HydrophobicContact CG-CD2 4.27Å; R168-L170 HydrophobicContact CG-CG 4.29Å
169	V	78.9	Confident	81.1	Confident	65 Å²	65	60.5 Å²	60.5	39%	0.394	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138.1	174.1	-174.1	0	0	0	0	110.7	L160 Y161 S167	L160-V169 HydrophobicContact CB-CG1 3.8Å; L160-V169 HydrophobicContact CD1-CG1 4.06Å; L160-V169 HydrophobicContact CG-CG1 4.36Å; Y161-V169 CarbonylContact O-C 3.5Å; Y161-V169 WeakPolarHBondContact O-CA 2.92Å; S167-V169 PolarHBondContact O-N 3.39Å
170	L	77.3	Confident	81.4	Confident	18 Å²	18	57.5 Å²	57.5	9%	0.094	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.9	-173.5	-64.5	164.9	0	0	0	110.1	Y161 R168 A175 F176 H179	Y161-L170 WeakPolarHBondContact CD2-O 3.17Å; Y161-L170 PolarHBondContact N-O 3.24Å; Y161-L170 PolarHBondContact O-N 3.43Å; R168-L170 HydrophobicContact CG-CD2 4.27Å; R168-L170 HydrophobicContact CG-CG 4.29Å; L170-A175 HydrophobicContact CB-CB 4.31Å; L170-A175 HydrophobicContact CD2-CB 4.47Å; L170-F176 HydrophobicContact CD1-CB 4.2Å; L170-H179 HydrophobicContact CD1-CB 3.52Å
171	H	71.6	Confident	81.7	Confident	134 Å²	134	61.9 Å²	61.9	62%	0.62	32%	0.323	S	S	*	.	S	Bend	trans	-90.3	8.6	-172	55.3	-108.4	0	0	0	114.7	L160	L160-H171 HydrophobicContact CD2-CB 4.16Å
172	S	74.4	Confident	82	Confident	41 Å²	41	66.2 Å²	66.2	29%	0.287	35%	0.345	S	S	.	.	S	Bend	trans	-160.5	152.6	176.1	58.7	0	0	0	0	112.4	S174 A175 F176	S172-S174 VanDerWaalsContact C-N 3.34Å; S172-S174 PolarHBondContact O-N 3.37Å; S172-A175 PolarHBondContact O-N 2.77Å; S172-A175 VanDerWaalsContact O-N 3.16Å; S172-A175 VanDerWaalsContact OG-CB 3.25Å; S172-A175 WeakPolarHBondContact OG-CB 3.19Å; S172-A175 PolarHBondContact OG-N 3.32Å; S172-F176 PolarHBondContact O-N 2.81Å
173	V	80	Confident	82.1	Confident	62 Å²	62	73.2 Å²	73.2	38%	0.376	37%	0.374	S	S	.	.	H	α-helix	trans	-54.6	-49.1	175.3	-174.9	0	0	0	0	110.8	Y161 A175 F176 E177	Y161-V173 HydrophobicContact CD1-CG2 4.31Å; Y161-V173 HydrophobicContact CE1-CG2 3.55Å; Y161-V173 HydrophobicContact CE2-CG2 4.22Å; V173-A175 VanDerWaalsContact C-N 3.27Å; V173-A175 PolarHBondContact O-N 3.04Å; V173-F176 CarbonylContact O-C 3.56Å; V173-F176 WeakPolarHBondContact O-CA 3.47Å; V173-F176 VanDerWaalsContact O-CB 3.32Å; V173-F176 WeakPolarHBondContact O-CB 3.48Å; V173-F176 PolarHBondContact O-N 2.59Å; V173-E177 HydrophobicContact CG1-CG 4.09Å; V173-E177 WeakPolarHBondContact O-CG 3.43Å; V173-E177 PolarHBondContact O-N 2.82Å
174	S	84.1	Confident	82.2	Confident	82 Å²	82	75.6 Å²	75.6	57%	0.573	39%	0.385	S	S	*	.	H	α-helix	trans	-69.2	-21.6	-178.4	-49.8	0	0	0	0	114.1	S172 E177 R178	S172-S174 VanDerWaalsContact C-N 3.34Å; S172-S174 PolarHBondContact O-N 3.37Å; S174-E177 WeakPolarHBondContact CA-OE2 3.49Å; S174-R178 WeakPolarHBondContact O-CB 3.47Å; S174-R178 PolarHBondContact O-N 3.3Å
175	A	83.6	Confident	81.7	Confident	7 Å²	7	72.1 Å²	72.1	6%	0.058	38%	0.378	C	S	.	.	H	α-helix	trans	-74.4	-38.5	167.4	0	0	0	0	0	111.5	L170 S172 V173 H179	L170-A175 HydrophobicContact CB-CB 4.31Å; L170-A175 HydrophobicContact CD2-CB 4.47Å; S172-A175 PolarHBondContact O-N 2.77Å; S172-A175 VanDerWaalsContact O-N 3.16Å; S172-A175 VanDerWaalsContact OG-CB 3.25Å; S172-A175 WeakPolarHBondContact OG-CB 3.19Å; S172-A175 PolarHBondContact OG-N 3.32Å; V173-A175 VanDerWaalsContact C-N 3.27Å; V173-A175 PolarHBondContact O-N 3.04Å; A175-H179 WeakPolarHBondContact O-CB 3.42Å; A175-H179 PolarHBondContact O-N 3.46Å
176	F	82.2	Confident	80.9	Confident	8 Å²	8	77.5 Å²	77.5	4%	0.035	39%	0.394	C	S	.	.	H	α-helix	trans	-64	-53.7	174.1	173.6	-87	0	0	0	112.3	C163 L170 S172 V173 R178 H179 C180 P192	C163-F176 HydrophobicContact CB-CD2 4.3Å; C163-F176 HydrophobicContact CB-CE2 4.01Å; L170-F176 HydrophobicContact CD1-CB 4.2Å; S172-F176 PolarHBondContact O-N 2.81Å; V173-F176 CarbonylContact O-C 3.56Å; V173-F176 WeakPolarHBondContact O-CA 3.47Å; V173-F176 VanDerWaalsContact O-CB 3.32Å; V173-F176 WeakPolarHBondContact O-CB 3.48Å; V173-F176 PolarHBondContact O-N 2.59Å; F176-R178 VanDerWaalsContact C-N 3.35Å; F176-R178 PolarHBondContact O-N 3.46Å; F176-H179 WeakPolarHBondContact O-CA 3.26Å; F176-H179 WeakPolarHBondContact O-CB 3.28Å; F176-H179 PolarHBondContact O-N 3.12Å; F176-C180 PolarHBondContact O-N 3.42Å; F176-C180 PolarHBondContact O-SG 2.97Å; F176-C180 VanDerWaalsContact O-SG 3.38Å; F176-P192 HydrophobicContact CD1-CB 4.22Å; F176-P192 HydrophobicContact CD1-CG 4.46Å; F176-P192 HydrophobicContact CD2-CB 3.86Å; F176-P192 HydrophobicContact CE1-CB 3.94Å; F176-P192 HydrophobicContact CE1-CG 4.19Å; F176-P192 HydrophobicContact CE2-CB 3.52Å; F176-P192 HydrophobicContact CG-CB 4.19Å; F176-P192 HydrophobicContact CZ-CB 3.58Å; F176-P192 HydrophobicContact CZ-CG 4.27Å
177	E	83.9	Confident	79.8	Confident	86 Å²	86	84.3 Å²	84.3	40%	0.402	42%	0.419	S	S	.	.	H	α-helix	trans	-54.6	-50.7	178.4	-68	168.6	146.5	0	0	111.2	V173 S174 H179 C180 Q181	V173-E177 HydrophobicContact CG1-CG 4.09Å; V173-E177 WeakPolarHBondContact O-CG 3.43Å; V173-E177 PolarHBondContact O-N 2.82Å; S174-E177 WeakPolarHBondContact CA-OE2 3.49Å; E177-H179 VanDerWaalsContact C-N 3.32Å; E177-H179 PolarHBondContact O-N 3.37Å; E177-C180 PolarHBondContact O-N 3.47Å; E177-Q181 WeakPolarHBondContact O-CB 3.27Å; E177-Q181 WeakPolarHBondContact O-CG 3.12Å; E177-Q181 PolarHBondContact O-N 3.39Å
178	R	86.9	Confident	78.5	Confident	133 Å²	133	81.5 Å²	81.5	50%	0.502	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-38.4	176.8	-179.7	173.6	57.1	79.8	-4.5	112.1	S174 F176 Q182	S174-R178 WeakPolarHBondContact O-CB 3.47Å; S174-R178 PolarHBondContact O-N 3.3Å; F176-R178 VanDerWaalsContact C-N 3.35Å; F176-R178 PolarHBondContact O-N 3.46Å; R178-Q182 HydrophobicContact CG-CG 4.3Å; R178-Q182 WeakPolarHBondContact O-CB 3.27Å; R178-Q182 WeakPolarHBondContact O-CG 3.36Å; R178-Q182 PolarHBondContact O-N 3.19Å
179	H	86.7	Confident	77.1	Confident	22 Å²	22	78.2 Å²	78.2	10%	0.102	40%	0.396	C	S	.	.	H	α-helix	trans	-64.7	-49	176.6	169.4	59.9	0	0	0	111.9	C163 C166 L170 A175 F176 E177 Q182 K183 H184	C163-H179 VanDerWaalsContact SG-CD2 3.55Å; C166-H179 PolarHBondContact SG-NE2 3.2Å; L170-H179 HydrophobicContact CD1-CB 3.52Å; A175-H179 WeakPolarHBondContact O-CB 3.42Å; A175-H179 PolarHBondContact O-N 3.46Å; F176-H179 WeakPolarHBondContact O-CA 3.26Å; F176-H179 WeakPolarHBondContact O-CB 3.28Å; F176-H179 PolarHBondContact O-N 3.12Å; E177-H179 VanDerWaalsContact C-N 3.32Å; E177-H179 PolarHBondContact O-N 3.37Å; H179-Q182 PolarHBondContact O-N 2.88Å; H179-K183 WeakPolarHBondContact O-CB 3.44Å; H179-K183 PolarHBondContact O-N 2.8Å; H179-H184 AromaticContact CE1-NE2 3.92Å; H179-H184 AromaticContact NE2-NE2 3.31Å; H179-H184 PolarHBondContact NE2-NE2 2.92Å
180	C	84.7	Confident	76.2	Confident	2 Å²	2	83.7 Å²	83.7	1%	0.014	41%	0.409	C	S	.	.	H	α-helix	trans	-60.4	-47.7	177.9	-63.8	0	0	0	0	111	C163 F176 E177 Q182 K183 H184 G185 V189	C163-C180 VanDerWaalsContact SG-SG 3.62Å; F176-C180 PolarHBondContact O-N 3.42Å; F176-C180 PolarHBondContact O-SG 2.97Å; F176-C180 VanDerWaalsContact O-SG 3.38Å; E177-C180 PolarHBondContact O-N 3.47Å; C180-Q182 VanDerWaalsContact C-N 3.31Å; C180-Q182 PolarHBondContact O-N 3.18Å; C180-K183 PolarHBondContact O-N 2.7Å; C180-H184 CarbonylContact O-C 3.55Å; C180-H184 WeakPolarHBondContact O-CA 3.32Å; C180-H184 PolarHBondContact O-N 3.17Å; C180-G185 PolarHBondContact O-N 3.34Å; C180-G185 VanDerWaalsContact O-N 3.07Å; C180-V189 HydrophobicContact CB-CG2 4.13Å
181	Q	85.7	Confident	75.7	Confident	114 Å²	114	91.1 Å²	91.1	53%	0.533	44%	0.443	S	S	.	.	H	α-helix	trans	-57.7	-40.4	175	-69.8	168.2	18.2	0	0	112.8	E177	E177-Q181 WeakPolarHBondContact O-CB 3.27Å; E177-Q181 WeakPolarHBondContact O-CG 3.12Å; E177-Q181 PolarHBondContact O-N 3.39Å
182	Q	86.2	Confident	75.8	Confident	126 Å²	126	86.4 Å²	86.4	59%	0.589	43%	0.425	S	S	*	.	H	α-helix	trans	-82.5	-13.3	-177.4	-73.7	179.5	-20.4	0	0	115	R178 H179 C180	R178-Q182 HydrophobicContact CG-CG 4.3Å; R178-Q182 WeakPolarHBondContact O-CB 3.27Å; R178-Q182 WeakPolarHBondContact O-CG 3.36Å; R178-Q182 PolarHBondContact O-N 3.19Å; H179-Q182 PolarHBondContact O-N 2.88Å; C180-Q182 VanDerWaalsContact C-N 3.31Å; C180-Q182 PolarHBondContact O-N 3.18Å
183	K	84.5	Confident	76	Confident	157 Å²	157	86.1 Å²	86.1	68%	0.683	42%	0.421	S	S	*	.	H	α-helix	trans	-128.7	-28	-175.2	-69.6	-62.2	177.4	-166.1	0	116	H179 C180	H179-K183 WeakPolarHBondContact O-CB 3.44Å; H179-K183 PolarHBondContact O-N 2.8Å; C180-K183 PolarHBondContact O-N 2.7Å
184	H	83.9	Confident	76.1	Confident	52 Å²	52	86.3 Å²	86.3	24%	0.241	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-2.2	-173.9	-43.6	-50.9	0	0	0	113	C163 C166 H179 C180 S188	C163-H184 PolarHBondContact SG-CD2 3Å; C163-H184 PolarHBondContact SG-NE2 2.97Å; C166-H184 PolarHBondContact SG-NE2 2.96Å; H179-H184 AromaticContact CE1-NE2 3.92Å; H179-H184 AromaticContact NE2-NE2 3.31Å; H179-H184 PolarHBondContact NE2-NE2 2.92Å; C180-H184 CarbonylContact O-C 3.55Å; C180-H184 WeakPolarHBondContact O-CA 3.32Å; C180-H184 PolarHBondContact O-N 3.17Å; H184-S188 VanDerWaalsContact CB-CB 3.43Å; H184-S188 WeakPolarHBondContact CB-OG 3.45Å; H184-S188 WeakPolarHBondContact O-CB 3.29Å
185	G	71.9	Confident	75.9	Confident	33 Å²	33	84.5 Å²	84.5	34%	0.34	40%	0.401	S	S	.	.			trans	77.4	177.9	-178.5	0	0	0	0	0	113.7	C180	C180-G185 PolarHBondContact O-N 3.34Å; C180-G185 VanDerWaalsContact O-N 3.07Å
186	K	63.5	Low	75.7	Confident	186 Å²	186	86.6 Å²	86.6	81%	0.809	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-69.8	-30.1	-177.3	-70.1	-175.2	176.9	-178.2	0	113.4	S188 V189	K186-S188 VanDerWaalsContact C-N 3.33Å; K186-S188 PolarHBondContact O-N 3.07Å; K186-V189 WeakPolarHBondContact O-CG2 3.24Å
187	E	60.2	Low	75.4	Confident	202 Å²	202	86.9 Å²	86.9	94%	0.944	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-78.9	-15.6	-174.5	-62.7	173.5	165.1	0	0	113.2
188	S	54.3	Low	75	Confident	36 Å²	36	83.3 Å²	83.3	25%	0.252	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-91.4	9.4	-178.4	-164.7	0	0	0	0	113.9	H184 K186 R190	H184-S188 VanDerWaalsContact CB-CB 3.43Å; H184-S188 WeakPolarHBondContact CB-OG 3.45Å; H184-S188 WeakPolarHBondContact O-CB 3.29Å; K186-S188 VanDerWaalsContact C-N 3.33Å; K186-S188 PolarHBondContact O-N 3.07Å; S188-R190 PolarHBondContact O-N 3.23Å
189	V	54	Low	74.2	Confident	76 Å²	76	78.1 Å²	78.1	46%	0.461	38%	0.383	S	S	.	.			trans	-77.5	70.4	179.1	-170.9	0	0	0	0	110.6	C180 K186	C180-V189 HydrophobicContact CB-CG2 4.13Å; K186-V189 WeakPolarHBondContact O-CG2 3.24Å
190	R	61.4	Low	73.2	Confident	181 Å²	181	78 Å²	78	68%	0.683	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-71.4	154.9	159.5	-65.3	-176	178.5	-177.4	-0.7	109.2	S188	S188-R190 PolarHBondContact O-N 3.23Å
191	H	65.7	Low	71.6	Confident	173 Å²	173	83.3 Å²	83.3	80%	0.801	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-56.2	137.6	-178.9	-59.3	-75.9	0	0	0	111.1	T193	H191-T193 PolarHBondContact O-N 3.22Å
192	P	74	Confident	70.2	Confident	36 Å²	36	84.3 Å²	84.3	23%	0.234	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-60.9	132.1	177.7	23.5	-32.7	0	0	0	110.6	Y161 F176 L194	Y161-P192 HydrophobicContact CD1-CB 3.91Å; Y161-P192 HydrophobicContact CD1-CG 3.87Å; Y161-P192 HydrophobicContact CG-CB 4.48Å; F176-P192 HydrophobicContact CD1-CB 4.22Å; F176-P192 HydrophobicContact CD1-CG 4.46Å; F176-P192 HydrophobicContact CD2-CB 3.86Å; F176-P192 HydrophobicContact CE1-CB 3.94Å; F176-P192 HydrophobicContact CE1-CG 4.19Å; F176-P192 HydrophobicContact CE2-CB 3.52Å; F176-P192 HydrophobicContact CG-CB 4.19Å; F176-P192 HydrophobicContact CZ-CB 3.58Å; F176-P192 HydrophobicContact CZ-CG 4.27Å; P192-L194 HydrophobicContact CG-CD2 4.29Å; P192-L194 PolarHBondContact O-N 2.82Å
193	T	79.6	Confident	69	Low	35 Å²	35	79.9 Å²	79.9	22%	0.215	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	111.2	167.8	-30	0	0	0	0	107.6	S162 E164 H191	S162-T193 WeakPolarHBondContact CB-O 3.49Å; S162-T193 PolarHBondContact N-O 3.46Å; S162-T193 PolarHBondContact O-N 3.2Å; S162-T193 VanDerWaalsContact O-N 3.12Å; E164-T193 WeakPolarHBondContact CG-OG1 3.5Å; E164-T193 PolarHBondContact OE1-OG1 2.84Å; H191-T193 PolarHBondContact O-N 3.22Å
194	L	81.6	Confident	68.4	Low	66 Å²	66	78 Å²	78	35%	0.346	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	141.5	-179.2	-61.8	-178.8	0	0	0	111.2	L159 Y161 P192	L159-L194 HydrophobicContact CD1-CB 4.21Å; L159-L194 HydrophobicContact CD1-CD1 4.49Å; L159-L194 HydrophobicContact CD1-CD2 4.23Å; Y161-L194 HydrophobicContact CD1-CD2 3.55Å; Y161-L194 HydrophobicContact CE1-CD2 3.57Å; P192-L194 HydrophobicContact CG-CD2 4.29Å; P192-L194 PolarHBondContact O-N 2.82Å
195	Y	78.7	Confident	68.2	Low	44 Å²	44	79.5 Å²	79.5	17%	0.173	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136.6	172.3	-84.4	-98.8	0	0	0	109.4	L160 T207 R208	L160-Y195 PolarHBondContact N-O 3.07Å; L160-Y195 PolarHBondContact O-N 2.87Å; Y195-T207 CarbonylContact C-O 3.11Å; Y195-T207 VanDerWaalsContact CA-O 3.3Å; Y195-T207 WeakPolarHBondContact CA-O 3.45Å; Y195-R208 HydrophobicContact CD1-CG 4.01Å; Y195-R208 HydrophobicContact CD2-CG 4.41Å; Y195-R208 HydrophobicContact CE1-CG 3.77Å; Y195-R208 HydrophobicContact CE2-CG 4.19Å; Y195-R208 HydrophobicContact CG-CG 4.35Å; Y195-R208 VanDerWaalsContact CZ-NE 3.33Å; Y195-R208 PolarHBondContact OH-NE 3.19Å; Y195-R208 PolarHBondContact OH-NH2 2.87Å
196	Y	80.5	Confident	68.7	Low	50 Å²	50	84.1 Å²	84.1	20%	0.196	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.1	172.7	-54	-78.5	0	0	0	108.5	T157 L159 K206 T207 R210 L213	T157-Y196 HydrophobicContact CG2-CD1 3.97Å; T157-Y196 HydrophobicContact CG2-CG 4.32Å; L159-Y196 HydrophobicContact CD1-CD1 3.98Å; L159-Y196 HydrophobicContact CD1-CE1 3.87Å; Y196-K206 CarbonylContact O-C 3.56Å; Y196-K206 WeakPolarHBondContact O-CA 3.35Å; Y196-T207 HydrophobicContact CD2-CG2 4.38Å; Y196-T207 PolarHBondContact N-O 3.42Å; Y196-T207 PolarHBondContact O-N 2.87Å; Y196-R210 HydrophobicContact CE2-CB 4.24Å; Y196-L213 HydrophobicContact CD1-CD2 4.1Å; Y196-L213 HydrophobicContact CG-CD2 3.96Å
197	A	75.3	Confident	69.7	Low	15 Å²	15	75.7 Å²	75.7	12%	0.124	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.2	172.6	0	0	0	0	0	110.8	T157 E158 L160 G199 K206	T157-A197 WeakPolarHBondContact CA-O 3.4Å; T157-A197 WeakPolarHBondContact CG2-O 3.11Å; E158-A197 HydrophobicContact CB-CB 4.33Å; E158-A197 PolarHBondContact N-O 3.35Å; E158-A197 PolarHBondContact O-N 3.4Å; L160-A197 HydrophobicContact CD1-CB 3.83Å; L160-A197 HydrophobicContact CG-CB 4.44Å; A197-G199 PolarHBondContact O-N 3.31Å; A197-K206 HydrophobicContact CB-CB 4.22Å
198	C	76.3	Confident	70.7	Confident	10 Å²	10	73.9 Å²	73.9	7%	0.068	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	115.8	-177.2	-172.8	0	0	0	0	111.2	I200 C203 W205 H216 F217	C198-I200 PolarHBondContact O-N 3.23Å; C198-C203 HydrophobicContact CB-CB 4.05Å; C198-W205 PolarHBondContact N-O 2.98Å; C198-H216 PolarHBondContact SG-NE2 3.34Å; C198-H216 VanDerWaalsContact SG-NE2 3.45Å; C198-F217 VanDerWaalsContact SG-CE1 3.58Å
199	G	69.4	Low	72	Confident	24 Å²	24	74 Å²	74	25%	0.247	38%	0.384	C	S	.	.			trans	-83.2	11.5	-179.7	0	0	0	0	0	114.9	H156 A197	H156-G199 WeakPolarHBondContact O-CA 3.18Å; H156-G199 PolarHBondContact O-N 3.29Å; A197-G199 PolarHBondContact O-N 3.31Å
200	I	65.8	Low	73.3	Confident	20 Å²	20	75.3 Å²	75.3	10%	0.103	38%	0.38	C	S	.	.	S	Bend	trans	-73.7	125.4	168.1	-67.3	170.3	0	0	0	108.2	P136 V137 L152 C198 S202 C203 F217 H220	P136-I200 HydrophobicContact CG-CD1 4.32Å; V137-I200 HydrophobicContact CG2-CB 4.27Å; V137-I200 HydrophobicContact CG2-CG1 3.58Å; L152-I200 HydrophobicContact CD2-CD1 4.34Å; C198-I200 PolarHBondContact O-N 3.23Å; I200-S202 PolarHBondContact O-N 2.76Å; I200-C203 HydrophobicContact CB-CB 4.37Å; I200-C203 VanDerWaalsContact O-CB 3.26Å; I200-C203 WeakPolarHBondContact O-CB 3.3Å; I200-C203 PolarHBondContact O-N 3.43Å; I200-F217 HydrophobicContact CD1-CD1 3.75Å; I200-F217 HydrophobicContact CD1-CE1 3.76Å; I200-F217 HydrophobicContact CG1-CE1 4.13Å; I200-H220 HydrophobicContact CD1-CB 3.75Å; I200-H220 VanDerWaalsContact CD1-CG 3.44Å
201	L	52	Low	74.5	Confident	113 Å²	113	70.8 Å²	70.8	59%	0.592	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	138.3	178.4	-74.2	155.5	0	0	0	111	C203	L201-C203 PolarHBondContact O-N 2.85Å
202	S	55.9	Low	75.5	Confident	135 Å²	135	67.1 Å²	67.1	94%	0.944	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	-2.6	-170.8	78.2	0	0	0	0	116.9	I200	I200-S202 PolarHBondContact O-N 2.76Å
203	C	61.6	Low	76	Confident	33 Å²	33	65.4 Å²	65.4	22%	0.223	34%	0.342	C	S	.	.			trans	-87.3	138.7	168.1	-156.7	0	0	0	0	111.5	C198 I200 L201 H216	C198-C203 HydrophobicContact CB-CB 4.05Å; I200-C203 HydrophobicContact CB-CB 4.37Å; I200-C203 VanDerWaalsContact O-CB 3.26Å; I200-C203 WeakPolarHBondContact O-CB 3.3Å; I200-C203 PolarHBondContact O-N 3.43Å; L201-C203 PolarHBondContact O-N 2.85Å; C203-H216 PolarHBondContact SG-NE2 2.9Å
204	S	71.9	Confident	76.2	Confident	117 Å²	117	68 Å²	68	82%	0.818	35%	0.35	S	S	*	.			trans	-119.8	9.2	174.1	57.3	0	0	0	0	112.8
205	W	78.7	Confident	76.4	Confident	84 Å²	84	71 Å²	71	32%	0.318	36%	0.362	S	S	.	.			trans	-73.9	142.9	-174.3	-171.7	99.1	0	0	0	111.7	C198 T207 Q212 L213 H216	C198-W205 PolarHBondContact N-O 2.98Å; W205-T207 HydrophobicContact CE3-CG2 4.48Å; W205-T207 VanDerWaalsContact CH2-CB 3.43Å; W205-T207 HydrophobicContact CH2-CG2 3.39Å; W205-T207 HydrophobicContact CZ2-CG2 4.49Å; W205-T207 HydrophobicContact CZ3-CG2 3.38Å; W205-Q212 HydrophobicContact CH2-CB 3.97Å; W205-Q212 VanDerWaalsContact CH2-O 3.28Å; W205-Q212 WeakPolarHBondContact CH2-O 3.35Å; W205-Q212 HydrophobicContact CZ2-CB 4.41Å; W205-L213 HydrophobicContact CZ3-CD1 4.13Å; W205-H216 HydrophobicContact CD2-CB 4.13Å; W205-H216 AromaticContact CD2-CD2 3.69Å; W205-H216 AromaticContact CD2-CG 3.57Å; W205-H216 AromaticContact CD2-ND1 3.79Å; W205-H216 AromaticContact CD2-NE2 3.97Å; W205-H216 AromaticContact CE2-CG 3.94Å; W205-H216 HydrophobicContact CE3-CB 3.88Å; W205-H216 AromaticContact CE3-CD2 3.31Å; W205-H216 AromaticContact CE3-CG 3.49Å; W205-H216 VanDerWaalsContact CE3-CG 3.49Å; W205-H216 AromaticContact CE3-NE2 3.93Å; W205-H216 AromaticContact CG-CE1 3.71Å; W205-H216 AromaticContact CG-ND1 3.86Å; W205-H216 AromaticContact CG-NE2 3.87Å; W205-H216 HydrophobicContact CH2-CB 3.61Å; W205-H216 HydrophobicContact CZ2-CB 3.89Å; W205-H216 HydrophobicContact CZ3-CB 3.61Å; W205-H216 AromaticContact CZ3-CD2 3.83Å; W205-H216 AromaticContact CZ3-CG 3.78Å
206	K	81.5	Confident	76.6	Confident	131 Å²	131	69.2 Å²	69.2	57%	0.57	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.6	146.1	-176.8	62.1	-172.6	174.4	-173.9	0	112.1	Y196 A197	Y196-K206 CarbonylContact O-C 3.56Å; Y196-K206 WeakPolarHBondContact O-CA 3.35Å; A197-K206 HydrophobicContact CB-CB 4.22Å
207	T	85.3	Confident	76.7	Confident	8 Å²	8	66.9 Å²	66.9	5%	0.049	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	168.4	179.7	-178.1	0	0	0	0	112	Y195 Y196 W205 S209 Q212 L213	Y195-T207 CarbonylContact C-O 3.11Å; Y195-T207 VanDerWaalsContact CA-O 3.3Å; Y195-T207 WeakPolarHBondContact CA-O 3.45Å; Y196-T207 HydrophobicContact CD2-CG2 4.38Å; Y196-T207 PolarHBondContact N-O 3.42Å; Y196-T207 PolarHBondContact O-N 2.87Å; W205-T207 HydrophobicContact CE3-CG2 4.48Å; W205-T207 VanDerWaalsContact CH2-CB 3.43Å; W205-T207 HydrophobicContact CH2-CG2 3.39Å; W205-T207 HydrophobicContact CZ2-CG2 4.49Å; W205-T207 HydrophobicContact CZ3-CG2 3.38Å; T207-S209 WeakPolarHBondContact CG2-O 3.22Å; T207-S209 PolarHBondContact OG1-N 2.83Å; T207-Q212 HydrophobicContact CG2-CB 4.29Å; T207-Q212 PolarHBondContact OG1-OE1 3.32Å; T207-L213 HydrophobicContact CG2-CB 4.02Å
208	R	81.8	Confident	77	Confident	164 Å²	164	68.4 Å²	68.4	62%	0.619	36%	0.356	S	S	*	.	S	Bend	trans	-96.1	-10.4	165.9	-61.6	176.5	-178.2	163.4	-2.9	112.9	Y195	Y195-R208 HydrophobicContact CD1-CG 4.01Å; Y195-R208 HydrophobicContact CD2-CG 4.41Å; Y195-R208 HydrophobicContact CE1-CG 3.77Å; Y195-R208 HydrophobicContact CE2-CG 4.19Å; Y195-R208 HydrophobicContact CG-CG 4.35Å; Y195-R208 VanDerWaalsContact CZ-NE 3.33Å; Y195-R208 PolarHBondContact OH-NE 3.19Å; Y195-R208 PolarHBondContact OH-NH2 2.87Å
209	S	80.4	Confident	77.1	Confident	40 Å²	40	73.2 Å²	73.2	28%	0.28	38%	0.377	S	S	.	.			trans	-107.8	130.3	-175	173.4	0	0	0	0	112.4	T207 D211 Q212 L213	T207-S209 WeakPolarHBondContact CG2-O 3.22Å; T207-S209 PolarHBondContact OG1-N 2.83Å; S209-D211 PolarHBondContact O-N 2.94Å; S209-D211 PolarHBondContact OG-N 3.01Å; S209-Q212 PolarHBondContact OG-N 3.1Å; S209-L213 PolarHBondContact O-N 2.82Å
210	R	83.1	Confident	77.2	Confident	102 Å²	102	74.3 Å²	74.3	39%	0.385	38%	0.376	S	S	.	.	H	α-helix	trans	-68.5	-20.6	174.5	-173	170.8	175.9	140.9	7.5	112.3	I153 D154 Y196 K214	I153-R210 HydrophobicContact CG2-CG 4.33Å; I153-R210 VanDerWaalsContact CG2-NH2 3.34Å; D154-R210 IonicContact OD1-CZ 2.74Å; D154-R210 IonicContact OD1-NH1 2.66Å; D154-R210 IonicContact OD1-NH2 3.14Å; D154-R210 PolarHBondContact OD1-NH2 3.37Å; D154-R210 IonicContact OD2-NH2 3.39Å; Y196-R210 HydrophobicContact CE2-CB 4.24Å; R210-K214 PolarHBondContact O-N 3.22Å
211	D	85.7	Confident	77.6	Confident	87 Å²	87	75.9 Å²	75.9	47%	0.465	38%	0.384	S	S	.	.	H	α-helix	trans	-85	-39.9	179.2	-59.6	-56.9	0	0	0	112.1	S209 L213 K214 E215	S209-D211 PolarHBondContact O-N 2.94Å; S209-D211 PolarHBondContact OG-N 3.01Å; D211-L213 PolarHBondContact O-N 3.36Å; D211-K214 WeakPolarHBondContact O-CB 3.41Å; D211-K214 PolarHBondContact O-N 3.46Å; D211-K214 WeakPolarHBondContact OD1-CE 3.46Å; D211-K214 IonicContact OD1-NZ 2.59Å; D211-K214 PolarHBondContact OD1-NZ 3.4Å; D211-E215 WeakPolarHBondContact O-CG 3.44Å; D211-E215 PolarHBondContact O-N 3.33Å
212	Q	86.4	Confident	78.2	Confident	96 Å²	96	75.2 Å²	75.2	45%	0.449	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-31.8	167.7	-69.4	-177.5	-15.8	0	0	111.7	W205 T207 S209 E215 H216	W205-Q212 HydrophobicContact CH2-CB 3.97Å; W205-Q212 VanDerWaalsContact CH2-O 3.28Å; W205-Q212 WeakPolarHBondContact CH2-O 3.35Å; W205-Q212 HydrophobicContact CZ2-CB 4.41Å; T207-Q212 HydrophobicContact CG2-CB 4.29Å; T207-Q212 PolarHBondContact OG1-OE1 3.32Å; S209-Q212 PolarHBondContact OG-N 3.1Å; Q212-E215 PolarHBondContact O-N 2.96Å; Q212-H216 VanDerWaalsContact O-CB 3.31Å; Q212-H216 WeakPolarHBondContact O-CB 3.37Å; Q212-H216 PolarHBondContact O-N 3.2Å
213	L	83.8	Confident	78.1	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-66.5	-38.3	173.5	-178.3	73	0	0	0	112.2	I153 T157 Y196 W205 T207 S209 D211 F217	I153-L213 HydrophobicContact CB-CD2 4.31Å; I153-L213 HydrophobicContact CG1-CD2 3.93Å; I153-L213 HydrophobicContact CG1-CG 4.23Å; I153-L213 HydrophobicContact CG2-CD2 3.79Å; T157-L213 HydrophobicContact CG2-CD1 4.24Å; T157-L213 HydrophobicContact CG2-CD2 3.87Å; Y196-L213 HydrophobicContact CD1-CD2 4.1Å; Y196-L213 HydrophobicContact CG-CD2 3.96Å; W205-L213 HydrophobicContact CZ3-CD1 4.13Å; T207-L213 HydrophobicContact CG2-CB 4.02Å; S209-L213 PolarHBondContact O-N 2.82Å; D211-L213 PolarHBondContact O-N 3.36Å; L213-F217 HydrophobicContact CD1-CD2 4.18Å; L213-F217 HydrophobicContact CD1-CE2 3.62Å; L213-F217 HydrophobicContact CD1-CZ 4.17Å; L213-F217 HydrophobicContact CD2-CE2 4.18Å; L213-F217 HydrophobicContact CG-CD2 3.96Å; L213-F217 HydrophobicContact CG-CE2 3.65Å; L213-F217 WeakPolarHBondContact O-CD2 2.22Å; L213-F217 PolarHBondContact O-N 2.94Å
214	K	85.4	Confident	77.2	Confident	89 Å²	89	80.3 Å²	80.3	39%	0.387	39%	0.394	S	S	.	.	H	α-helix	trans	-61	-51.3	171	-67.6	165.1	-173.1	165.9	0	110.4	I153 R210 D211 H216 F217 C218	I153-K214 HydrophobicContact CD1-CB 4.46Å; I153-K214 HydrophobicContact CD1-CG 3.48Å; I153-K214 VanDerWaalsContact CD1-CG 3.48Å; R210-K214 PolarHBondContact O-N 3.22Å; D211-K214 WeakPolarHBondContact O-CB 3.41Å; D211-K214 PolarHBondContact O-N 3.46Å; D211-K214 WeakPolarHBondContact OD1-CE 3.46Å; D211-K214 IonicContact OD1-NZ 2.59Å; D211-K214 PolarHBondContact OD1-NZ 3.4Å; K214-H216 VanDerWaalsContact C-N 3.31Å; K214-H216 PolarHBondContact O-N 3.07Å; K214-F217 PolarHBondContact O-N 3.4Å; K214-F217 VanDerWaalsContact O-N 3.13Å; K214-C218 PolarHBondContact O-N 3.45Å; K214-C218 PolarHBondContact O-SG 3.47Å; K214-C218 VanDerWaalsContact O-SG 3.34Å
215	E	85.3	Confident	75.8	Confident	128 Å²	128	78.4 Å²	78.4	60%	0.598	39%	0.385	S	S	*	.	H	α-helix	trans	-55.3	-47	178.8	-68	167.9	170.8	0	0	111.1	D211 Q212 F217 C218 E219	D211-E215 WeakPolarHBondContact O-CG 3.44Å; D211-E215 PolarHBondContact O-N 3.33Å; Q212-E215 PolarHBondContact O-N 2.96Å; E215-F217 PolarHBondContact O-N 3.4Å; E215-C218 WeakPolarHBondContact O-CA 3.47Å; E215-C218 VanDerWaalsContact O-CB 3.27Å; E215-C218 WeakPolarHBondContact O-CB 2.22Å; E215-C218 PolarHBondContact O-N 2.8Å; E215-C218 VanDerWaalsContact O-N 3.11Å; E215-E219 PolarHBondContact O-N 3.15Å
216	H	83	Confident	74.1	Confident	8 Å²	8	81.1 Å²	81.1	4%	0.037	41%	0.406	C	S	.	.	H	α-helix	trans	-63.3	-39.8	176.3	179.9	57.8	0	0	0	113.3	C198 C203 W205 Q212 K214 C218 E219 H220	C198-H216 PolarHBondContact SG-NE2 3.34Å; C198-H216 VanDerWaalsContact SG-NE2 3.45Å; C203-H216 PolarHBondContact SG-NE2 2.9Å; W205-H216 HydrophobicContact CD2-CB 4.13Å; W205-H216 AromaticContact CD2-CD2 3.69Å; W205-H216 AromaticContact CD2-CG 3.57Å; W205-H216 AromaticContact CD2-ND1 3.79Å; W205-H216 AromaticContact CD2-NE2 3.97Å; W205-H216 AromaticContact CE2-CG 3.94Å; W205-H216 HydrophobicContact CE3-CB 3.88Å; W205-H216 AromaticContact CE3-CD2 3.31Å; W205-H216 AromaticContact CE3-CG 3.49Å; W205-H216 VanDerWaalsContact CE3-CG 3.49Å; W205-H216 AromaticContact CE3-NE2 3.93Å; W205-H216 AromaticContact CG-CE1 3.71Å; W205-H216 AromaticContact CG-ND1 3.86Å; W205-H216 AromaticContact CG-NE2 3.87Å; W205-H216 HydrophobicContact CH2-CB 3.61Å; W205-H216 HydrophobicContact CZ2-CB 3.89Å; W205-H216 HydrophobicContact CZ3-CB 3.61Å; W205-H216 AromaticContact CZ3-CD2 3.83Å; W205-H216 AromaticContact CZ3-CG 3.78Å; Q212-H216 VanDerWaalsContact O-CB 3.31Å; Q212-H216 WeakPolarHBondContact O-CB 3.37Å; Q212-H216 PolarHBondContact O-N 3.2Å; K214-H216 VanDerWaalsContact C-N 3.31Å; K214-H216 PolarHBondContact O-N 3.07Å; H216-C218 VanDerWaalsContact C-N 3.3Å; H216-C218 PolarHBondContact O-N 3.38Å; H216-E219 IonicContact CE1-OE2 3.83Å; H216-E219 IonicContact CG-OE2 3.71Å; H216-E219 IonicContact ND1-OE2 2.72Å; H216-E219 PolarHBondContact ND1-OE2 3.35Å; H216-E219 VanDerWaalsContact O-CB 3.32Å; H216-E219 WeakPolarHBondContact O-CB 2.22Å; H216-E219 PolarHBondContact O-N 3.34Å; H216-E219 VanDerWaalsContact O-N 3.12Å; H216-H220 AromaticContact CD2-NE2 3.86Å; H216-H220 AromaticContact CE1-CD2 3.75Å; H216-H220 AromaticContact CE1-NE2 3.19Å; H216-H220 PolarHBondContact CE1-NE2 3.47Å; H216-H220 AromaticContact NE2-CD2 3.56Å; H216-H220 AromaticContact NE2-NE2 2.95Å; H216-H220 PolarHBondContact NE2-NE2 3.43Å; H216-H220 PolarHBondContact O-CD2 2.9Å; H216-H220 VanDerWaalsContact O-CD2 3.27Å; H216-H220 PolarHBondContact O-N 2.82Å
217	F	82.2	Confident	72.5	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-65.6	-33.8	172.3	-77.5	-53.6	0	0	0	112.3	L149 L152 I153 T157 C198 I200 L213 K214 E215 E219 H220 L221	L149-F217 HydrophobicContact CD2-CB 3.71Å; L152-F217 HydrophobicContact CB-CD1 3.85Å; L152-F217 HydrophobicContact CB-CD2 3.88Å; L152-F217 HydrophobicContact CB-CE1 3.94Å; L152-F217 HydrophobicContact CB-CE2 3.96Å; L152-F217 HydrophobicContact CB-CG 3.83Å; L152-F217 HydrophobicContact CB-CZ 4Å; L152-F217 HydrophobicContact CD1-CB 4.13Å; L152-F217 HydrophobicContact CD1-CD1 4.02Å; L152-F217 HydrophobicContact CD1-CG 4.16Å; L152-F217 HydrophobicContact CD2-CD1 4.12Å; L152-F217 HydrophobicContact CD2-CE1 4.07Å; L152-F217 HydrophobicContact CG-CD1 4.22Å; L152-F217 HydrophobicContact CG-CE1 4.47Å; L152-F217 HydrophobicContact CG-CG 4.5Å; L152-F217 WeakPolarHBondContact O-CZ 3.38Å; I153-F217 HydrophobicContact CB-CE2 4.49Å; I153-F217 HydrophobicContact CG1-CD2 3.74Å; I153-F217 HydrophobicContact CG1-CE2 3.78Å; T157-F217 WeakPolarHBondContact OG1-CE2 3.31Å; T157-F217 WeakPolarHBondContact OG1-CZ 3.47Å; C198-F217 VanDerWaalsContact SG-CE1 3.58Å; I200-F217 HydrophobicContact CD1-CD1 3.75Å; I200-F217 HydrophobicContact CD1-CE1 3.76Å; I200-F217 HydrophobicContact CG1-CE1 4.13Å; L213-F217 HydrophobicContact CD1-CD2 4.18Å; L213-F217 HydrophobicContact CD1-CE2 3.62Å; L213-F217 HydrophobicContact CD1-CZ 4.17Å; L213-F217 HydrophobicContact CD2-CE2 4.18Å; L213-F217 HydrophobicContact CG-CD2 3.96Å; L213-F217 HydrophobicContact CG-CE2 3.65Å; L213-F217 WeakPolarHBondContact O-CD2 2.22Å; L213-F217 PolarHBondContact O-N 2.94Å; K214-F217 PolarHBondContact O-N 3.4Å; K214-F217 VanDerWaalsContact O-N 3.13Å; E215-F217 PolarHBondContact O-N 3.4Å; F217-E219 VanDerWaalsContact C-N 3.3Å; F217-E219 PolarHBondContact O-N 3.49Å; F217-H220 PolarHBondContact O-N 3.41Å; F217-L221 WeakPolarHBondContact O-CG 3.18Å; F217-L221 PolarHBondContact O-N 3.46Å; F217-L221 VanDerWaalsContact O-N 3.14Å
218	C	82.6	Confident	70.8	Confident	47 Å²	47	80.1 Å²	80.1	32%	0.318	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-37.9	169.1	-63.3	0	0	0	0	111.8	K214 E215 H216 H220 L221 S222	K214-C218 PolarHBondContact O-N 3.45Å; K214-C218 PolarHBondContact O-SG 3.47Å; K214-C218 VanDerWaalsContact O-SG 3.34Å; E215-C218 WeakPolarHBondContact O-CA 3.47Å; E215-C218 VanDerWaalsContact O-CB 3.27Å; E215-C218 WeakPolarHBondContact O-CB 2.22Å; E215-C218 PolarHBondContact O-N 2.8Å; E215-C218 VanDerWaalsContact O-N 3.11Å; H216-C218 VanDerWaalsContact C-N 3.3Å; H216-C218 PolarHBondContact O-N 3.38Å; C218-H220 VanDerWaalsContact C-N 3.29Å; C218-H220 PolarHBondContact O-N 2.86Å; C218-L221 CarbonylContact O-C 3.49Å; C218-L221 PolarHBondContact O-N 3.25Å; C218-L221 VanDerWaalsContact O-N 3.13Å; C218-S222 VanDerWaalsContact O-CB 3.3Å; C218-S222 WeakPolarHBondContact O-CB 2.23Å; C218-S222 PolarHBondContact O-N 3.47Å; C218-S222 PolarHBondContact O-OG 3.35Å
219	E	77.8	Confident	69.1	Low	111 Å²	111	76 Å²	76	52%	0.519	39%	0.393	S	S	.	.	H	α-helix	trans	-58.2	-38.6	174.2	-57.1	-179.9	131.9	0	0	112.7	E215 H216 F217 R223	E215-E219 PolarHBondContact O-N 3.15Å; H216-E219 IonicContact CE1-OE2 3.83Å; H216-E219 IonicContact CG-OE2 3.71Å; H216-E219 IonicContact ND1-OE2 2.72Å; H216-E219 PolarHBondContact ND1-OE2 3.35Å; H216-E219 VanDerWaalsContact O-CB 3.32Å; H216-E219 WeakPolarHBondContact O-CB 2.22Å; H216-E219 PolarHBondContact O-N 3.34Å; H216-E219 VanDerWaalsContact O-N 3.12Å; F217-E219 VanDerWaalsContact C-N 3.3Å; F217-E219 PolarHBondContact O-N 3.49Å; E219-R223 WeakPolarHBondContact O-CG 3.37Å; E219-R223 PolarHBondContact O-N 2.92Å
220	H	71.7	Confident	67.6	Low	47 Å²	47	74.1 Å²	74.1	22%	0.218	38%	0.38	C	S	.	.	H	α-helix	trans	-70.8	-32.8	176.7	-72.7	-83.3	0	0	0	112.9	I200 H216 F217 C218	I200-H220 HydrophobicContact CD1-CB 3.75Å; I200-H220 VanDerWaalsContact CD1-CG 3.44Å; H216-H220 AromaticContact CD2-NE2 3.86Å; H216-H220 AromaticContact CE1-CD2 3.75Å; H216-H220 AromaticContact CE1-NE2 3.19Å; H216-H220 PolarHBondContact CE1-NE2 3.47Å; H216-H220 AromaticContact NE2-CD2 3.56Å; H216-H220 AromaticContact NE2-NE2 2.95Å; H216-H220 PolarHBondContact NE2-NE2 3.43Å; H216-H220 PolarHBondContact O-CD2 2.9Å; H216-H220 VanDerWaalsContact O-CD2 3.27Å; H216-H220 PolarHBondContact O-N 2.82Å; F217-H220 PolarHBondContact O-N 3.41Å; C218-H220 VanDerWaalsContact C-N 3.29Å; C218-H220 PolarHBondContact O-N 2.86Å
221	L	73.1	Confident	65.9	Low	54 Å²	54	74.5 Å²	74.5	28%	0.283	40%	0.396	S	S	.	.	H	α-helix	trans	-82.4	-25.5	177.7	-60.5	179.6	0	0	0	112.9	P136 L148 L149 L152 F217 C218	P136-L221 HydrophobicContact CG-CD2 4.47Å; L148-L221 HydrophobicContact CD2-CD1 3.66Å; L148-L221 HydrophobicContact CD2-CD2 3.72Å; L148-L221 HydrophobicContact CD2-CG 4.36Å; L148-L221 HydrophobicContact CG-CD1 4.04Å; L149-L221 HydrophobicContact CD2-CD1 3.89Å; L149-L221 HydrophobicContact CG-CD1 4.38Å; L152-L221 HydrophobicContact CD1-CD1 4.16Å; L152-L221 HydrophobicContact CD1-CD2 4.33Å; L152-L221 HydrophobicContact CD1-CG 4.4Å; F217-L221 WeakPolarHBondContact O-CG 3.18Å; F217-L221 PolarHBondContact O-N 3.46Å; F217-L221 VanDerWaalsContact O-N 3.14Å; C218-L221 CarbonylContact O-C 3.49Å; C218-L221 PolarHBondContact O-N 3.25Å; C218-L221 VanDerWaalsContact O-N 3.13Å
222	S	65	Low	63.8	Low	98 Å²	98	73.4 Å²	73.4	69%	0.685	40%	0.395	S	S	*	.	H	α-helix	trans	-89.8	-5.5	177.3	-59.1	0	0	0	0	114	C218	C218-S222 VanDerWaalsContact O-CB 3.3Å; C218-S222 WeakPolarHBondContact O-CB 2.23Å; C218-S222 PolarHBondContact O-N 3.47Å; C218-S222 PolarHBondContact O-OG 3.35Å
223	R	53.3	Low	61.8	Low	186 Å²	186	70.1 Å²	70.1	70%	0.702	38%	0.382	S	S	*	.	S	Bend	trans	-67.2	134.9	173.4	-91.4	175.8	174.5	-161.7	-2.9	110.2	E219	E219-R223 WeakPolarHBondContact O-CG 3.37Å; E219-R223 PolarHBondContact O-N 2.92Å
224	P	43.6	Very low	59.9	Low	89 Å²	89	70.4 Å²	70.4	58%	0.578	39%	0.386	S	S	*	.			trans	-62.1	154.9	-163	-27.2	36.7	0	0	0	115.6	D226	P224-D226 VanDerWaalsContact CB-OD2 3.23Å; P224-D226 WeakPolarHBondContact CB-OD2 3.39Å; P224-D226 PolarHBondContact O-N 3.06Å
225	A	41.5	Very low	58	Low	77 Å²	77	70.3 Å²	70.3	64%	0.636	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	3.1	-178.5	0	0	0	0	0	114.8	L227	A225-L227 VanDerWaalsContact C-N 3.32Å; A225-L227 PolarHBondContact O-N 3.38Å
226	D	43.5	Very low	56.1	Low	141 Å²	141	68.1 Å²	68.1	75%	0.754	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-9.1	-173.5	-49.4	-54.3	0	0	0	113.9	P224 P228	P224-D226 VanDerWaalsContact CB-OD2 3.23Å; P224-D226 WeakPolarHBondContact CB-OD2 3.39Å; P224-D226 PolarHBondContact O-N 3.06Å; D226-P228 WeakPolarHBondContact O-CD 3.24Å
227	L	49	Very low	54.6	Low	89 Å²	89	69.4 Å²	69.4	47%	0.466	38%	0.38	S	S	.	.	S	Bend	trans	-86.5	117.3	178.4	-68.8	179.7	0	0	0	111.5	A225 R229 I236	A225-L227 VanDerWaalsContact C-N 3.32Å; A225-L227 PolarHBondContact O-N 3.38Å; L227-R229 PolarHBondContact O-N 3.12Å; L227-I236 HydrophobicContact CB-CG2 3.58Å; L227-I236 HydrophobicContact CD1-CG2 4.18Å
228	P	48.5	Very low	53	Low	30 Å²	30	77.6 Å²	77.6	20%	0.195	42%	0.418	C	S	.	.			trans	-62.2	134.3	-173.6	18.2	-28.2	0	0	0	112.9	D226 F237 T239 E240 L243	D226-P228 WeakPolarHBondContact O-CD 3.24Å; P228-F237 WeakPolarHBondContact CD-O 3.13Å; P228-F237 HydrophobicContact CG-CB 4.39Å; P228-F237 PolarHBondContact O-N 2.86Å; P228-T239 VanDerWaalsContact CG-C 3.43Å; P228-E240 HydrophobicContact CG-CB 4.43Å; P228-L243 HydrophobicContact CB-CB 4.24Å; P228-L243 HydrophobicContact CB-CD2 3.76Å
229	R	45.4	Very low	51.7	Low	77 Å²	77	78.4 Å²	78.4	29%	0.291	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-115.5	138.3	-175.1	-172.5	-169.6	-65.3	-84.8	7.2	111	L227 C231 G234 R235 I236	L227-R229 PolarHBondContact O-N 3.12Å; R229-C231 PolarHBondContact O-N 3.48Å; R229-G234 WeakPolarHBondContact CG-O 3.35Å; R229-G234 PolarHBondContact NH1-O 2.97Å; R229-G234 VanDerWaalsContact NH1-O 3.17Å; R229-R235 CarbonylContact C-O 3.59Å; R229-R235 WeakPolarHBondContact CA-O 3.28Å; R229-I236 HydrophobicContact CG-CG1 4.47Å
230	C	49.6	Very low	50.6	Low	1 Å²	1	79.5 Å²	79.5	1%	0.007	43%	0.427	C	S	.	.			trans	-73.5	123.4	169.6	-174.6	0	0	0	0	111.1	C232 G234 R235 F237 L243 H246	C230-C232 VanDerWaalsContact C-N 3.34Å; C230-C232 PolarHBondContact SG-N 3.1Å; C230-C232 VanDerWaalsContact SG-N 3.36Å; C230-G234 WeakPolarHBondContact O-CA 3.36Å; C230-G234 PolarHBondContact O-N 3.25Å; C230-R235 PolarHBondContact N-O 3.4Å; C230-F237 HydrophobicContact CB-CE2 4.1Å; C230-L243 VanDerWaalsContact CA-CD1 3.45Å; C230-L243 HydrophobicContact CB-CD1 3.63Å; C230-H246 PolarHBondContact SG-NE2 3.22Å
231	C	47.2	Very low	50.4	Low	109 Å²	109	80.6 Å²	80.6	74%	0.736	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-39.6	170.7	48.4	0	0	0	0	112.7	R229	R229-C231 PolarHBondContact O-N 3.48Å
232	C	42	Very low	49.8	Very low	65 Å²	65	80.5 Å²	80.5	44%	0.439	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-25.8	-173.1	-51.6	0	0	0	0	115	C230 H251	C230-C232 VanDerWaalsContact C-N 3.34Å; C230-C232 PolarHBondContact SG-N 3.1Å; C230-C232 VanDerWaalsContact SG-N 3.36Å; C232-H251 HydrophobicContact CB-CB 4.36Å; C232-H251 VanDerWaalsContact CB-CE1 3.48Å; C232-H251 WeakPolarHBondContact CB-CE1 3.35Å; C232-H251 WeakPolarHBondContact CB-ND1 3.49Å
233	C	45	Very low	49.4	Very low	26 Å²	26	76.7 Å²	76.7	18%	0.176	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.5	8.8	-178	79.3	0	0	0	0	115.3	Y139 R235 H246	Y139-C233 WeakPolarHBondContact CE2-O 3.47Å; Y139-C233 PolarHBondContact OH-O 3.3Å; C233-R235 PolarHBondContact O-N 3.47Å; C233-R235 VanDerWaalsContact SG-CG 3.6Å; C233-H246 PolarHBondContact SG-CE1 3.03Å; C233-H246 PolarHBondContact SG-NE2 3.46Å
234	G	43.8	Very low	49.7	Very low	7 Å²	7	72.2 Å²	72.2	7%	0.072	40%	0.401	C	S	.	.			trans	67	-6.4	173	0	0	0	0	0	117.5	Y139 R229 C230	Y139-G234 VanDerWaalsContact CE1-CA 3.45Å; Y139-G234 VanDerWaalsContact CZ-CA 3.44Å; Y139-G234 VanDerWaalsContact OH-C 3.22Å; R229-G234 WeakPolarHBondContact CG-O 3.35Å; R229-G234 PolarHBondContact NH1-O 2.97Å; R229-G234 VanDerWaalsContact NH1-O 3.17Å; C230-G234 WeakPolarHBondContact O-CA 3.36Å; C230-G234 PolarHBondContact O-N 3.25Å
235	R	44.5	Very low	51	Low	86 Å²	86	74.1 Å²	74.1	33%	0.325	40%	0.4	S	S	.	.			trans	-53.5	138.6	176.4	-72.4	-177.8	-173	-147.2	4.8	110.7	Y139 R229 C230 C233 F237 H411	Y139-R235 PolarHBondContact OH-N 3.45Å; R229-R235 CarbonylContact C-O 3.59Å; R229-R235 WeakPolarHBondContact CA-O 3.28Å; C230-R235 PolarHBondContact N-O 3.4Å; C233-R235 PolarHBondContact O-N 3.47Å; C233-R235 VanDerWaalsContact SG-CG 3.6Å; R235-F237 HydrophobicContact CB-CE2 3.6Å; R235-F237 HydrophobicContact CB-CZ 3.74Å; R235-F237 WeakPolarHBondContact O-CD2 3.31Å; R235-F237 VanDerWaalsContact O-CE2 3.31Å; R235-F237 WeakPolarHBondContact O-CE2 3.31Å; R235-H411 PolarHBondContact NH2-CD2 2.87Å; R235-H411 PolarHBondContact NH2-CE1 2.88Å; R235-H411 PolarHBondContact NH2-NE2 3.03Å
236	I	46.4	Very low	52	Low	83 Å²	83	70.9 Å²	70.9	43%	0.426	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-101.6	138.8	178.7	-55.2	173.8	0	0	0	108.9	L227 R229	L227-I236 HydrophobicContact CB-CG2 3.58Å; L227-I236 HydrophobicContact CD1-CG2 4.18Å; R229-I236 HydrophobicContact CG-CG1 4.47Å
237	F	50.1	Low	52.4	Low	34 Å²	34	66.7 Å²	66.7	15%	0.149	35%	0.348	C	S	.	.			trans	-120.8	152.9	-175.2	-65.9	-86.6	0	0	0	111.7	P228 C230 R235 D242 L243 H246	P228-F237 WeakPolarHBondContact CD-O 3.13Å; P228-F237 HydrophobicContact CG-CB 4.39Å; P228-F237 PolarHBondContact O-N 2.86Å; C230-F237 HydrophobicContact CB-CE2 4.1Å; R235-F237 HydrophobicContact CB-CE2 3.6Å; R235-F237 HydrophobicContact CB-CZ 3.74Å; R235-F237 WeakPolarHBondContact O-CD2 3.31Å; R235-F237 VanDerWaalsContact O-CE2 3.31Å; R235-F237 WeakPolarHBondContact O-CE2 3.31Å; F237-D242 HydrophobicContact CB-CB 4.22Å; F237-D242 HydrophobicContact CD1-CB 3.84Å; F237-D242 HydrophobicContact CG-CB 4.4Å; F237-L243 HydrophobicContact CB-CB 4.17Å; F237-L243 HydrophobicContact CD2-CB 3.82Å; F237-L243 HydrophobicContact CD2-CD1 3.95Å; F237-L243 HydrophobicContact CD2-CG 4.48Å; F237-L243 HydrophobicContact CE2-CD1 4.02Å; F237-L243 HydrophobicContact CG-CB 4.02Å; F237-H246 HydrophobicContact CE1-CB 3.62Å; F237-H246 AromaticContact CE1-CG 3.95Å; F237-H246 HydrophobicContact CE2-CB 4.29Å; F237-H246 AromaticContact CE2-CD2 3.52Å; F237-H246 AromaticContact CE2-CG 4Å; F237-H246 HydrophobicContact CZ-CB 3.46Å; F237-H246 VanDerWaalsContact CZ-CB 3.46Å; F237-H246 AromaticContact CZ-CD2 3.28Å; F237-H246 WeakPolarHBondContact CZ-CD2 3.45Å; F237-H246 AromaticContact CZ-CG 3.27Å
238	Q	49.2	Very low	53.2	Low	173 Å²	173	65.5 Å²	65.5	81%	0.808	35%	0.351	S	S	*	.	S	Bend	trans	-77.1	-26.3	177.9	-68.9	-175.5	-11.3	0	0	112.7
239	T	55.8	Low	54.1	Low	64 Å²	64	67.3 Å²	67.3	39%	0.393	37%	0.368	S	S	.	.	S	Bend	trans	-139.7	155.5	175.8	78.1	0	0	0	0	110.8	P228 S241 D242 L243	P228-T239 VanDerWaalsContact CG-C 3.43Å; T239-S241 PolarHBondContact O-N 3.41Å; T239-S241 PolarHBondContact OG1-N 3.35Å; T239-D242 PolarHBondContact O-N 3.27Å; T239-D242 PolarHBondContact OG1-N 3.09Å; T239-D242 PolarHBondContact OG1-OD2 3.29Å; T239-L243 PolarHBondContact O-N 3.27Å
240	E	54.7	Low	54.2	Low	133 Å²	133	68.7 Å²	68.7	62%	0.621	38%	0.376	S	S	*	.	H	α-helix	trans	-60.8	-34.1	174.6	-174.2	-176.1	-168.9	0	0	111.2	P228 D242 L243 L244	P228-E240 HydrophobicContact CG-CB 4.43Å; E240-D242 PolarHBondContact O-N 3.03Å; E240-L243 WeakPolarHBondContact O-CB 3.36Å; E240-L243 PolarHBondContact O-N 3.44Å; E240-L244 HydrophobicContact CG-CD1 4.14Å; E240-L244 HydrophobicContact CG-CG 4.41Å; E240-L244 WeakPolarHBondContact O-CG 3.46Å; E240-L244 PolarHBondContact O-N 3.2Å
241	S	66.1	Low	54.7	Low	71 Å²	71	70.4 Å²	70.4	50%	0.497	38%	0.384	S	S	.	.	H	α-helix	trans	-60.8	-29.7	174.2	-72.1	0	0	0	0	113.1	T239 K245	T239-S241 PolarHBondContact O-N 3.41Å; T239-S241 PolarHBondContact OG1-N 3.35Å; S241-K245 VanDerWaalsContact O-CD 3.31Å; S241-K245 WeakPolarHBondContact O-CD 3.13Å; S241-K245 VanDerWaalsContact O-CE 3.31Å; S241-K245 WeakPolarHBondContact O-CE 3.39Å; S241-K245 WeakPolarHBondContact O-CG 3.19Å; S241-K245 PolarHBondContact O-N 3.47Å; S241-K245 VanDerWaalsContact O-N 3.12Å
242	D	61.4	Low	54.9	Low	52 Å²	52	69.2 Å²	69.2	28%	0.278	38%	0.377	S	S	.	.	H	α-helix	trans	-82.6	-34.2	177.7	-57	-47.5	0	0	0	112	F237 T239 E240 K245 H246	F237-D242 HydrophobicContact CB-CB 4.22Å; F237-D242 HydrophobicContact CD1-CB 3.84Å; F237-D242 HydrophobicContact CG-CB 4.4Å; T239-D242 PolarHBondContact O-N 3.27Å; T239-D242 PolarHBondContact OG1-N 3.09Å; T239-D242 PolarHBondContact OG1-OD2 3.29Å; E240-D242 PolarHBondContact O-N 3.03Å; D242-K245 IonicContact OD1-NZ 2.78Å; D242-K245 PolarHBondContact OD1-NZ 3.35Å; D242-H246 WeakPolarHBondContact O-CB 3.37Å; D242-H246 PolarHBondContact O-N 2.96Å
243	L	57.6	Low	54.9	Low	18 Å²	18	74.6 Å²	74.6	9%	0.094	40%	0.396	C	S	.	.	H	α-helix	trans	-58.6	-49.9	166.9	168.3	58.5	0	0	0	110.9	P228 C230 F237 T239 E240 K245 H246 Q247	P228-L243 HydrophobicContact CB-CB 4.24Å; P228-L243 HydrophobicContact CB-CD2 3.76Å; C230-L243 VanDerWaalsContact CA-CD1 3.45Å; C230-L243 HydrophobicContact CB-CD1 3.63Å; F237-L243 HydrophobicContact CB-CB 4.17Å; F237-L243 HydrophobicContact CD2-CB 3.82Å; F237-L243 HydrophobicContact CD2-CD1 3.95Å; F237-L243 HydrophobicContact CD2-CG 4.48Å; F237-L243 HydrophobicContact CE2-CD1 4.02Å; F237-L243 HydrophobicContact CG-CB 4.02Å; T239-L243 PolarHBondContact O-N 3.27Å; E240-L243 WeakPolarHBondContact O-CB 3.36Å; E240-L243 PolarHBondContact O-N 3.44Å; L243-K245 PolarHBondContact O-N 3.48Å; L243-H246 CarbonylContact O-C 3.53Å; L243-H246 WeakPolarHBondContact O-CB 3.43Å; L243-H246 PolarHBondContact O-N 3.37Å; L243-H246 VanDerWaalsContact O-N 3.14Å; L243-Q247 HydrophobicContact CD1-CG 3.9Å; L243-Q247 PolarHBondContact O-N 3.45Å
244	L	59.4	Low	54.6	Low	92 Å²	92	77.2 Å²	77.2	48%	0.482	41%	0.414	S	S	.	.	H	α-helix	trans	-63.8	-41.8	-179.2	-70.7	170.4	0	0	0	112.3	E240 H246 Q247 A248	E240-L244 HydrophobicContact CG-CD1 4.14Å; E240-L244 HydrophobicContact CG-CG 4.41Å; E240-L244 WeakPolarHBondContact O-CG 3.46Å; E240-L244 PolarHBondContact O-N 3.2Å; L244-H246 VanDerWaalsContact C-N 3.3Å; L244-H246 PolarHBondContact O-N 2.91Å; L244-Q247 PolarHBondContact O-N 3.18Å; L244-A248 WeakPolarHBondContact O-CB 3.22Å; L244-A248 PolarHBondContact O-N 3.42Å
245	K	70.3	Confident	54.1	Low	129 Å²	129	81 Å²	81	56%	0.561	44%	0.444	S	S	*	.	H	α-helix	trans	-57.5	-44.3	171.3	-72.9	162.1	-154.2	161	0	111.3	S241 D242 L243 A248 A249	S241-K245 VanDerWaalsContact O-CD 3.31Å; S241-K245 WeakPolarHBondContact O-CD 3.13Å; S241-K245 VanDerWaalsContact O-CE 3.31Å; S241-K245 WeakPolarHBondContact O-CE 3.39Å; S241-K245 WeakPolarHBondContact O-CG 3.19Å; S241-K245 PolarHBondContact O-N 3.47Å; S241-K245 VanDerWaalsContact O-N 3.12Å; D242-K245 IonicContact OD1-NZ 2.78Å; D242-K245 PolarHBondContact OD1-NZ 3.35Å; L243-K245 PolarHBondContact O-N 3.48Å; K245-A248 PolarHBondContact O-N 3.2Å; K245-A249 VanDerWaalsContact O-CB 3.27Å; K245-A249 WeakPolarHBondContact O-CB 3.13Å; K245-A249 PolarHBondContact O-N 3.37Å
246	H	62.3	Low	53.4	Low	9 Å²	9	81.2 Å²	81.2	4%	0.042	46%	0.464	C	S	.	.	H	α-helix	trans	-68	-42.9	179.1	158.1	68.4	0	0	0	112.3	C230 C233 F237 D242 L243 L244 A248 A249 F250 H251	C230-H246 PolarHBondContact SG-NE2 3.22Å; C233-H246 PolarHBondContact SG-CE1 3.03Å; C233-H246 PolarHBondContact SG-NE2 3.46Å; F237-H246 HydrophobicContact CE1-CB 3.62Å; F237-H246 AromaticContact CE1-CG 3.95Å; F237-H246 HydrophobicContact CE2-CB 4.29Å; F237-H246 AromaticContact CE2-CD2 3.52Å; F237-H246 AromaticContact CE2-CG 4Å; F237-H246 HydrophobicContact CZ-CB 3.46Å; F237-H246 VanDerWaalsContact CZ-CB 3.46Å; F237-H246 AromaticContact CZ-CD2 3.28Å; F237-H246 WeakPolarHBondContact CZ-CD2 3.45Å; F237-H246 AromaticContact CZ-CG 3.27Å; D242-H246 WeakPolarHBondContact O-CB 3.37Å; D242-H246 PolarHBondContact O-N 2.96Å; L243-H246 CarbonylContact O-C 3.53Å; L243-H246 WeakPolarHBondContact O-CB 3.43Å; L243-H246 PolarHBondContact O-N 3.37Å; L243-H246 VanDerWaalsContact O-N 3.14Å; L244-H246 VanDerWaalsContact C-N 3.3Å; L244-H246 PolarHBondContact O-N 2.91Å; H246-A248 VanDerWaalsContact C-N 3.34Å; H246-A248 PolarHBondContact O-N 3.14Å; H246-A249 PolarHBondContact O-N 2.9Å; H246-F250 AromaticContact CE1-CD2 3.98Å; H246-F250 AromaticContact ND1-CD2 3.24Å; H246-F250 WeakPolarHBondContact ND1-CD2 3.41Å; H246-F250 AromaticContact ND1-CE2 3.97Å; H246-F250 AromaticContact ND1-CG 3.81Å; H246-F250 WeakPolarHBondContact O-CB 3.37Å; H246-F250 WeakPolarHBondContact O-CD2 3.24Å; H246-F250 PolarHBondContact O-N 3.17Å; H246-H251 AromaticContact CE1-CD2 3.68Å; H246-H251 AromaticContact CE1-NE2 3.46Å; H246-H251 PolarHBondContact CE1-NE2 3.38Å; H246-H251 AromaticContact NE2-CD2 3.45Å; H246-H251 PolarHBondContact NE2-CD2 3.09Å; H246-H251 AromaticContact NE2-NE2 3.41Å; H246-H251 PolarHBondContact NE2-NE2 2.87Å
247	Q	51.5	Low	52.6	Low	52 Å²	52	81.7 Å²	81.7	24%	0.243	48%	0.481	C	S	.	.	H	α-helix	trans	-61.7	-42.2	174.2	-76.7	172	-46.5	0	0	111.1	L243 L244 A249 H251 S252	L243-Q247 HydrophobicContact CD1-CG 3.9Å; L243-Q247 PolarHBondContact O-N 3.45Å; L244-Q247 PolarHBondContact O-N 3.18Å; Q247-A249 PolarHBondContact O-N 2.87Å; Q247-H251 CarbonylContact O-C 3.59Å; Q247-H251 WeakPolarHBondContact O-CA 3.39Å; Q247-H251 WeakPolarHBondContact O-CB 3.19Å; Q247-H251 PolarHBondContact O-N 2.84Å; Q247-S252 PolarHBondContact O-N 3.14Å
248	A	65.8	Low	51.5	Low	64 Å²	64	87.7 Å²	87.7	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-36.6	174.7	0	0	0	0	0	113.4	L244 K245 H246 S252	L244-A248 WeakPolarHBondContact O-CB 3.22Å; L244-A248 PolarHBondContact O-N 3.42Å; K245-A248 PolarHBondContact O-N 3.2Å; H246-A248 VanDerWaalsContact C-N 3.34Å; H246-A248 PolarHBondContact O-N 3.14Å; A248-S252 WeakPolarHBondContact O-CB 3.41Å; A248-S252 PolarHBondContact O-OG 3.5Å
249	A	68.2	Low	50.6	Low	68 Å²	68	88 Å²	88	56%	0.562	52%	0.516	S	S	*	.	H	α-helix	trans	-79.3	-38.2	-178.9	0	0	0	0	0	114	K245 H246 Q247	K245-A249 VanDerWaalsContact O-CB 3.27Å; K245-A249 WeakPolarHBondContact O-CB 3.13Å; K245-A249 PolarHBondContact O-N 3.37Å; H246-A249 PolarHBondContact O-N 2.9Å; Q247-A249 PolarHBondContact O-N 2.87Å
250	F	47.6	Very low	49.4	Very low	106 Å²	106	87.7 Å²	87.7	47%	0.465	53%	0.526	S	S	.	.	H	α-helix	trans	-115.8	-16.2	-169.8	-63.7	-88.1	0	0	0	114.4	H246	H246-F250 AromaticContact CE1-CD2 3.98Å; H246-F250 AromaticContact ND1-CD2 3.24Å; H246-F250 WeakPolarHBondContact ND1-CD2 3.41Å; H246-F250 AromaticContact ND1-CE2 3.97Å; H246-F250 AromaticContact ND1-CG 3.81Å; H246-F250 WeakPolarHBondContact O-CB 3.37Å; H246-F250 WeakPolarHBondContact O-CD2 3.24Å; H246-F250 PolarHBondContact O-N 3.17Å
251	H	60.1	Low	48.2	Very low	37 Å²	37	90.4 Å²	90.4	17%	0.171	53%	0.532	C	S	.	.	S	Bend	trans	-132.3	15.1	-173.4	-58.9	-59.4	0	0	0	113.7	C232 H246 Q247 Q253 C254	C232-H251 HydrophobicContact CB-CB 4.36Å; C232-H251 VanDerWaalsContact CB-CE1 3.48Å; C232-H251 WeakPolarHBondContact CB-CE1 3.35Å; C232-H251 WeakPolarHBondContact CB-ND1 3.49Å; H246-H251 AromaticContact CE1-CD2 3.68Å; H246-H251 AromaticContact CE1-NE2 3.46Å; H246-H251 PolarHBondContact CE1-NE2 3.38Å; H246-H251 AromaticContact NE2-CD2 3.45Å; H246-H251 PolarHBondContact NE2-CD2 3.09Å; H246-H251 AromaticContact NE2-NE2 3.41Å; H246-H251 PolarHBondContact NE2-NE2 2.87Å; Q247-H251 CarbonylContact O-C 3.59Å; Q247-H251 WeakPolarHBondContact O-CA 3.39Å; Q247-H251 WeakPolarHBondContact O-CB 3.19Å; Q247-H251 PolarHBondContact O-N 2.84Å; H251-Q253 PolarHBondContact O-N 3.15Å; H251-Q253 VanDerWaalsContact O-N 3.08Å; H251-C254 HydrophobicContact CB-CB 4.28Å; H251-C254 VanDerWaalsContact O-CB 3.29Å; H251-C254 WeakPolarHBondContact O-CB 3.44Å; H251-C254 PolarHBondContact O-N 3.23Å
252	S	50.5	Low	46.4	Very low	84 Å²	84	90.9 Å²	90.9	59%	0.587	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.6	-180	36.9	0	0	0	0	114.8	Q247 A248	Q247-S252 PolarHBondContact O-N 3.14Å; A248-S252 WeakPolarHBondContact O-CB 3.41Å; A248-S252 PolarHBondContact O-OG 3.5Å
253	Q	43.1	Very low	44.9	Very low	179 Å²	179	92.6 Å²	92.6	84%	0.836	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-4	172.4	-62	-178.1	4.3	0	0	113.3	H251 A255	H251-Q253 PolarHBondContact O-N 3.15Å; H251-Q253 VanDerWaalsContact O-N 3.08Å; Q253-A255 VanDerWaalsContact C-N 3.3Å; Q253-A255 PolarHBondContact O-N 3.25Å
254	C	37.6	Very low	43.6	Very low	81 Å²	81	95.1 Å²	95.1	55%	0.547	59%	0.585	S	S	.	*	S	Bend	trans	-79.3	-8.6	-178.6	-60.9	0	0	0	0	113.8	H251 A256	H251-C254 HydrophobicContact CB-CB 4.28Å; H251-C254 VanDerWaalsContact O-CB 3.29Å; H251-C254 WeakPolarHBondContact O-CB 3.44Å; H251-C254 PolarHBondContact O-N 3.23Å; C254-A256 VanDerWaalsContact C-N 3.3Å; C254-A256 PolarHBondContact O-N 3.02Å
255	A	33.4	Very low	42.1	Very low	85 Å²	85	98.7 Å²	98.7	70%	0.702	60%	0.601	S	S	*	*			trans	-89.6	32.2	-174.6	0	0	0	0	0	114.1	Q253	Q253-A255 VanDerWaalsContact C-N 3.3Å; Q253-A255 PolarHBondContact O-N 3.25Å
256	A	30	Very low	40.2	Very low	92 Å²	92	102.6 Å²	102.6	76%	0.76	61%	0.612	S	S	*	*			trans	-108.2	28.9	-168.5	0	0	0	0	0	114.3	C254	C254-A256 VanDerWaalsContact C-N 3.3Å; C254-A256 PolarHBondContact O-N 3.02Å
257	A	29.4	Very low	38.7	Very low	93 Å²	93	106 Å²	106	77%	0.769	64%	0.643	S	S	*	*			trans	-135.6	6.1	-172.8	0	0	0	0	0	115.4
258	E	28.1	Very low	37.6	Very low	160 Å²	160	108.7 Å²	108.7	75%	0.748	66%	0.659	S	S	*	*			trans	-94	14.6	-170.2	-64.3	-166.8	156	0	0	115.7	G260	E258-G260 PolarHBondContact O-N 3.26Å; E258-G260 VanDerWaalsContact O-N 3.11Å
259	D	30	Very low	36	Very low	178 Å²	178	110.6 Å²	110.6	95%	0.952	67%	0.666	S	S	*	*	S	Bend	trans	-85.6	69.8	177.3	-73.4	-39.5	0	0	0	112.2
260	G	30.6	Very low	34.4	Very low	58 Å²	58	111.3 Å²	111.3	60%	0.598	67%	0.671	S	S	*	*	S	Bend	trans	-176.5	-57.2	172.5	0	0	0	0	0	117.7	E258	E258-G260 PolarHBondContact O-N 3.26Å; E258-G260 VanDerWaalsContact O-N 3.11Å
261	Y	28.5	Very low	33.8	Very low	190 Å²	190	110 Å²	110	75%	0.745	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-84.7	-27.3	-162.6	-99.5	-104.3	0	0	0	115.8	A263 A264	Y261-A263 PolarHBondContact O-N 3.14Å; Y261-A264 PolarHBondContact O-N 3.12Å; Y261-A264 VanDerWaalsContact O-N 3.15Å
262	A	29	Very low	32.7	Very low	82 Å²	82	111.7 Å²	111.7	68%	0.678	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-62.6	-20.4	-172.4	0	0	0	0	0	114.8
263	A	29.9	Very low	31.9	Very low	87 Å²	87	113.6 Å²	113.6	72%	0.719	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-82.6	-19.4	179.7	0	0	0	0	0	114.2	Y261	Y261-A263 PolarHBondContact O-N 3.14Å
264	A	30.5	Very low	31.4	Very low	71 Å²	71	112 Å²	112	59%	0.587	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-32	-169	0	0	0	0	0	114.3	Y261 W266	Y261-A264 PolarHBondContact O-N 3.12Å; Y261-A264 VanDerWaalsContact O-N 3.15Å; A264-W266 VanDerWaalsContact C-N 3.32Å; A264-W266 PolarHBondContact O-N 3.48Å
265	M	28.2	Very low	31.2	Very low	167 Å²	167	112.9 Å²	112.9	82%	0.823	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-9	-174.3	-68	-176.3	72.7	0	0	115
266	W	30.9	Very low	31.1	Very low	211 Å²	211	113.5 Å²	113.5	80%	0.799	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	20.4	-172.5	-67.7	69.7	0	0	0	113.1	A264	A264-W266 VanDerWaalsContact C-N 3.32Å; A264-W266 PolarHBondContact O-N 3.48Å
267	A	30.2	Very low	31.3	Very low	82 Å²	82	112.5 Å²	112.5	68%	0.678	67%	0.674	S	S	*	*			trans	-123.7	8.3	-169.1	0	0	0	0	0	115.2	P269	A267-P269 WeakPolarHBondContact O-CD 3.41Å
268	D	27.8	Very low	31.2	Very low	108 Å²	108	118.5 Å²	118.5	58%	0.578	68%	0.677	S	S	*	*			trans	-104.8	108.1	177.8	-169.4	-17.4	0	0	0	112.2	A270 S271	D268-A270 PolarHBondContact O-N 3.42Å; D268-A270 VanDerWaalsContact OD1-CB 3.29Å; D268-A270 WeakPolarHBondContact OD1-CB 3.21Å; D268-A270 PolarHBondContact OD1-N 3.47Å; D268-S271 PolarHBondContact O-OG 3.29Å
269	P	33.2	Very low	31.4	Very low	104 Å²	104	116.1 Å²	116.1	68%	0.675	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-67.1	-17.8	179.7	-20.1	33.8	0	0	0	115	A267 S271 T272	A267-P269 WeakPolarHBondContact O-CD 3.41Å; P269-S271 PolarHBondContact O-N 3.29Å; P269-T272 PolarHBondContact O-OG1 3.45Å
270	A	33.7	Very low	31.5	Very low	82 Å²	82	112 Å²	112	68%	0.678	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-74.4	-9.5	-170.1	0	0	0	0	0	114.4	D268	D268-A270 PolarHBondContact O-N 3.42Å; D268-A270 VanDerWaalsContact OD1-CB 3.29Å; D268-A270 WeakPolarHBondContact OD1-CB 3.21Å; D268-A270 PolarHBondContact OD1-N 3.47Å
271	S	36.3	Very low	31.5	Very low	78 Å²	78	113.4 Å²	113.4	55%	0.545	68%	0.675	S	S	.	*	G	3₁₀ helix	trans	-83.7	-13.5	-179.6	60.3	0	0	0	0	114.4	D268 P269 D273	D268-S271 PolarHBondContact O-OG 3.29Å; P269-S271 PolarHBondContact O-N 3.29Å; S271-D273 PolarHBondContact O-N 2.84Å
272	T	35.9	Very low	31.6	Very low	73 Å²	73	109.6 Å²	109.6	45%	0.448	68%	0.676	S	S	.	*	H	α-helix	trans	-71.5	-34.3	-163.8	-35.4	0	0	0	0	114.2	P269 V275 N276	P269-T272 PolarHBondContact O-OG1 3.45Å; T272-V275 PolarHBondContact O-N 3.25Å; T272-N276 PolarHBondContact O-N 3.32Å; T272-N276 PolarHBondContact O-ND2 3.45Å
273	D	34	Very low	31.4	Very low	125 Å²	125	109.5 Å²	109.5	67%	0.668	68%	0.683	S	S	*	*	H	α-helix	trans	-75.9	-30.2	-169.9	-65.9	-39.6	0	0	0	113.9	S271 V275 N276 A277	S271-D273 PolarHBondContact O-N 2.84Å; D273-V275 VanDerWaalsContact C-N 3.32Å; D273-V275 PolarHBondContact O-N 2.97Å; D273-N276 PolarHBondContact O-N 3.38Å; D273-A277 PolarHBondContact O-N 3.39Å; D273-A277 VanDerWaalsContact O-N 3.11Å
274	L	32.2	Very low	31.2	Very low	145 Å²	145	114 Å²	114	76%	0.759	69%	0.689	S	S	*	*	H	α-helix	trans	-68.3	-31	176.8	-77.9	167.9	0	0	0	112.6
275	V	32.9	Very low	30.9	Very low	99 Å²	99	119.3 Å²	119.3	60%	0.6	70%	0.699	S	S	*	*	H	α-helix	trans	-72.9	-43.3	176.6	-177.4	0	0	0	0	110.4	T272 D273 A277 W278	T272-V275 PolarHBondContact O-N 3.25Å; D273-V275 VanDerWaalsContact C-N 3.32Å; D273-V275 PolarHBondContact O-N 2.97Å; V275-A277 PolarHBondContact O-N 3.45Å; V275-W278 PolarHBondContact O-N 3.42Å
276	N	32.3	Very low	30.6	Very low	99 Å²	99	117.9 Å²	117.9	53%	0.529	69%	0.693	S	S	.	*	H	α-helix	trans	-66.2	-36.1	-179.4	-69.4	-31.2	0	0	0	112.8	T272 D273 W278 S279	T272-N276 PolarHBondContact O-N 3.32Å; T272-N276 PolarHBondContact O-ND2 3.45Å; D273-N276 PolarHBondContact O-N 3.38Å; N276-W278 VanDerWaalsContact C-N 3.27Å; N276-W278 PolarHBondContact O-N 2.8Å; N276-S279 PolarHBondContact O-N 2.89Å
277	A	33.4	Very low	30.3	Very low	70 Å²	70	112.7 Å²	112.7	58%	0.579	69%	0.689	S	S	*	*	H	α-helix	trans	-62.1	-31.2	178.7	0	0	0	0	0	113.4	D273 V275	D273-A277 PolarHBondContact O-N 3.39Å; D273-A277 VanDerWaalsContact O-N 3.11Å; V275-A277 PolarHBondContact O-N 3.45Å
278	W	28.9	Very low	29.9	Very low	220 Å²	220	113.3 Å²	113.3	83%	0.833	69%	0.689	S	S	*	*	H	α-helix	trans	-78.1	-25.3	-175.3	-126.8	-9.9	0	0	0	113.5	V275 N276 A280	V275-W278 PolarHBondContact O-N 3.42Å; N276-W278 VanDerWaalsContact C-N 3.27Å; N276-W278 PolarHBondContact O-N 2.8Å; W278-A280 VanDerWaalsContact C-N 3.28Å; W278-A280 PolarHBondContact O-N 3.41Å
279	S	30.8	Very low	29.8	Very low	109 Å²	109	114.2 Å²	114.2	76%	0.762	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-6	-178.5	-59.9	0	0	0	0	115	N276	N276-S279 PolarHBondContact O-N 2.89Å
280	A	32.8	Very low	29.4	Very low	93 Å²	93	112.5 Å²	112.5	77%	0.769	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-8.1	-173.3	0	0	0	0	0	115.2	W278	W278-A280 VanDerWaalsContact C-N 3.28Å; W278-A280 PolarHBondContact O-N 3.41Å
281	A	30	Very low	28.9	Very low	87 Å²	87	111.6 Å²	111.6	72%	0.719	69%	0.688	S	S	*	*	S	Bend	trans	-109.2	-8.8	-157.5	0	0	0	0	0	116.9
282	S	30.8	Very low	28.2	Very low	110 Å²	110	113.1 Å²	113.1	77%	0.769	70%	0.699	S	S	*	*			trans	-149.9	94.4	-174.8	60.9	0	0	0	0	112.8
283	G	24.7	Very low	27.7	Very low	80 Å²	80	117.5 Å²	117.5	83%	0.825	71%	0.708	S	S	*	*			trans	-100.7	105.3	168	0	0	0	0	0	111.1
284	E	26.4	Very low	27.2	Very low	182 Å²	182	119.1 Å²	119.1	85%	0.85	71%	0.709	S	S	*	*			trans	-166.4	128.2	138.1	-111.8	172.7	-168.5	0	0	113.2
285	F	23.5	Very low	26.6	Very low	182 Å²	182	118.1 Å²	118.1	80%	0.798	71%	0.713	S	S	*	*			trans	62	113.5	149.5	-90.7	-122.5	0	0	0	123.3
286	I	23.1	Very low	26.2	Very low	136 Å²	136	119.2 Å²	119.2	70%	0.697	72%	0.72	S	S	*	*			trans	87.3	101.9	140	-63.5	178.5	0	0	0	119.3
287	S	23.2	Very low	25.9	Very low	102 Å²	102	120.1 Å²	120.1	71%	0.713	73%	0.728	S	S	*	*			trans	55.4	143.2	142.9	74	0	0	0	0	121.9
288	S	22.3	Very low	25.4	Very low	95 Å²	95	120.3 Å²	120.3	66%	0.664	74%	0.737	S	S	*	*			cis	-177.1	139.8	-25.9	47.1	0	0	0	0	107.6
289	T	26	Very low	25.3	Very low	128 Å²	128	119.2 Å²	119.2	79%	0.785	74%	0.738	S	S	*	*			trans	66	133.3	-171.5	78.7	0	0	0	0	113.4
290	G	23.5	Very low	25	Very low	67 Å²	67	124 Å²	124	69%	0.691	75%	0.746	S	S	*	*			cis	110.7	60.4	-4.4	0	0	0	0	0	114.2	Y293	G290-Y293 PolarHBondContact N-OH 2.68Å
291	S	24.2	Very low	24.5	Very low	63 Å²	63	125.5 Å²	125.5	44%	0.441	75%	0.75	S	S	.	*			trans	-139.6	140.6	165.3	70.9	0	0	0	0	107.9	Y293	S291-Y293 WeakPolarHBondContact CB-OH 3.49Å; S291-Y293 PolarHBondContact N-OH 2.83Å; S291-Y293 WeakPolarHBondContact O-CD2 3.41Å; S291-Y293 WeakPolarHBondContact O-CE2 3.43Å; S291-Y293 WeakPolarHBondContact OG-CD1 3.22Å; S291-Y293 WeakPolarHBondContact OG-CD2 3.41Å; S291-Y293 WeakPolarHBondContact OG-CE1 3.49Å; S291-Y293 WeakPolarHBondContact OG-CE2 3.22Å; S291-Y293 PolarHBondContact OG-OH 3.47Å
292	S	22.1	Very low	24.1	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	76%	0.756	S	S	*	*			cis	61.9	28.8	-4.1	79.6	0	0	0	0	117.2	K294	S292-K294 PolarHBondContact O-N 2.85Å
293	Y	24.6	Very low	23.8	Very low	165 Å²	165	137.1 Å²	137.1	65%	0.647	77%	0.765	S	S	*	*			trans	-78.9	79.5	-176	-54.7	-82.4	0	0	0	111.3	G290 S291	G290-Y293 PolarHBondContact N-OH 2.68Å; S291-Y293 WeakPolarHBondContact CB-OH 3.49Å; S291-Y293 PolarHBondContact N-OH 2.83Å; S291-Y293 WeakPolarHBondContact O-CD2 3.41Å; S291-Y293 WeakPolarHBondContact O-CE2 3.43Å; S291-Y293 WeakPolarHBondContact OG-CD1 3.22Å; S291-Y293 WeakPolarHBondContact OG-CD2 3.41Å; S291-Y293 WeakPolarHBondContact OG-CE1 3.49Å; S291-Y293 WeakPolarHBondContact OG-CE2 3.22Å; S291-Y293 PolarHBondContact OG-OH 3.47Å
294	K	22.6	Very low	23.7	Very low	159 Å²	159	136.6 Å²	136.6	69%	0.691	76%	0.759	S	S	*	*			trans	-63.2	156.7	177.6	-69.8	179.8	174.6	-178.3	0	112.4	S292 V296	S292-K294 PolarHBondContact O-N 2.85Å; K294-V296 PolarHBondContact O-N 2.72Å
295	C	21.5	Very low	23.6	Very low	125 Å²	125	133.6 Å²	133.6	85%	0.845	76%	0.758	S	S	*	*			trans	-56.9	125.5	169.8	-173.8	0	0	0	0	112.1
296	V	24.2	Very low	23.6	Very low	122 Å²	122	135 Å²	135	74%	0.739	76%	0.764	S	S	*	*			trans	-147.4	121.7	177.2	175	0	0	0	0	104.7	K294	K294-V296 PolarHBondContact O-N 2.72Å
297	V	26	Very low	23.6	Very low	117 Å²	117	133.2 Å²	133.2	71%	0.709	77%	0.77	S	S	*	*			cis	-131.6	123.1	32.6	178	0	0	0	0	112.7	K299	V297-K299 HydrophobicContact CG1-CB 4.37Å
298	G	22.1	Very low	23.7	Very low	74 Å²	74	136.4 Å²	136.4	76%	0.763	78%	0.778	S	S	*	*			trans	-105.3	89.4	155.8	0	0	0	0	0	111.5
299	K	27.5	Very low	23.8	Very low	197 Å²	197	137.5 Å²	137.5	86%	0.857	79%	0.786	S	S	*	*			trans	-165.6	136.6	167.4	-109.7	147.3	-170.3	173.2	0	113	V297	V297-K299 HydrophobicContact CG1-CB 4.37Å
300	K	23.1	Very low	23.8	Very low	211 Å²	211	135.9 Å²	135.9	92%	0.917	78%	0.78	S	S	*	*			trans	-86.8	135.3	-176.6	-56.7	166.7	-178.3	172.4	0	111.4
301	S	23.8	Very low	23.8	Very low	123 Å²	123	138.6 Å²	138.6	86%	0.86	78%	0.783	S	S	*	*			trans	-161.9	176.1	151.2	57.6	0	0	0	0	111.3
302	R	21.9	Very low	23.9	Very low	226 Å²	226	142 Å²	142	85%	0.853	80%	0.8	S	S	*	*			trans	-100.8	-169.8	-168.6	-60.3	176.8	-179.3	157.5	-0.8	111.9
303	F	24	Very low	24.1	Very low	215 Å²	215	145.1 Å²	145.1	94%	0.943	80%	0.8	S	S	*	*			trans	75.8	147.1	-175.2	-47.9	-74.1	0	0	0	113.4
304	G	22.8	Very low	24.1	Very low	69 Å²	69	142.6 Å²	142.6	71%	0.711	80%	0.797	S	S	*	*			cis	172.9	139.3	-5.1	0	0	0	0	0	109.7
305	S	23.3	Very low	24.1	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	80%	0.801	S	S	*	*			trans	-72.7	133.4	-170.5	51	0	0	0	0	113.7
306	K	24.3	Very low	24.4	Very low	212 Å²	212	141.5 Å²	141.5	92%	0.922	80%	0.796	S	S	*	*			trans	-166.9	153.9	133.9	-104.1	154.4	-170.6	179.3	0	111.1
307	A	22.7	Very low	24.6	Very low	98 Å²	98	139.6 Å²	139.6	81%	0.81	79%	0.788	S	S	*	*			trans	-78.1	144.2	-174.1	0	0	0	0	0	112.3
308	L	26.2	Very low	24.5	Very low	169 Å²	169	139.6 Å²	139.6	89%	0.885	78%	0.784	S	S	*	*			trans	-129	119.3	157.1	-93.6	168.2	0	0	0	108.6
309	S	23.3	Very low	24.8	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	78%	0.781	S	S	*	*			trans	-93.3	112.5	177.1	154.3	0	0	0	0	109.5
310	S	25.6	Very low	24.9	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	78%	0.775	S	S	*	*			trans	-149	82.2	172.1	44.8	0	0	0	0	113.3	V312	S310-V312 PolarHBondContact O-N 3.46Å
311	T	24.2	Very low	25.1	Very low	123 Å²	123	133.8 Å²	133.8	76%	0.755	77%	0.765	S	S	*	*			trans	45.1	68.7	130.7	-40.3	0	0	0	0	118.1
312	V	26.3	Very low	25.3	Very low	134 Å²	134	131.7 Å²	131.7	81%	0.812	76%	0.755	S	S	*	*			trans	-110	84.2	156.1	-175	0	0	0	0	108.6	S310 L314	S310-V312 PolarHBondContact O-N 3.46Å; V312-L314 PolarHBondContact O-N 2.77Å
313	K	25	Very low	25.7	Very low	177 Å²	177	130 Å²	130	77%	0.77	76%	0.757	S	S	*	*			trans	-75.1	120.1	175.7	-73.6	-176.6	175.4	-179.8	0	109.5	P315	K313-P315 WeakPolarHBondContact O-CD 3.27Å
314	L	25.5	Very low	25.8	Very low	111 Å²	111	126 Å²	126	58%	0.581	75%	0.75	S	S	*	*			trans	-58.9	129.4	174.9	-80.6	71.4	0	0	0	110.6	V312 L316	V312-L314 PolarHBondContact O-N 2.77Å; L314-L316 PolarHBondContact O-N 3.06Å
315	P	23.6	Very low	26.2	Very low	118 Å²	118	130.9 Å²	130.9	77%	0.766	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-63	-22.5	168	-23.5	34.9	0	0	0	113.3	K313 C317	K313-P315 WeakPolarHBondContact O-CD 3.27Å; P315-C317 PolarHBondContact O-N 3.04Å
316	L	26.7	Very low	26.4	Very low	143 Å²	143	134 Å²	134	75%	0.749	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-73.4	-22.5	-165.6	-158.4	64.7	0	0	0	114.7	L314	L314-L316 PolarHBondContact O-N 3.06Å
317	C	27.7	Very low	26.6	Very low	83 Å²	83	133 Å²	133	56%	0.561	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-87.8	-17.7	-178.1	-65.1	0	0	0	0	114.5	P315	P315-C317 PolarHBondContact O-N 3.04Å
318	N	25.2	Very low	26.9	Very low	116 Å²	116	132.8 Å²	132.8	62%	0.62	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-85.5	-20.9	-173.4	-70.9	-14.8	0	0	0	113.7	I320 N321	N318-I320 PolarHBondContact O-N 3.47Å; N318-N321 PolarHBondContact O-N 3.32Å
319	A	28	Very low	27.3	Very low	85 Å²	85	130.3 Å²	130.3	70%	0.702	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-70.9	-11.2	-177.5	0	0	0	0	0	114.5
320	I	29.1	Very low	28	Very low	142 Å²	142	131.6 Å²	131.6	73%	0.728	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-93.9	-14.8	-176.2	-62.9	175.6	0	0	0	112.1	N318	N318-I320 PolarHBondContact O-N 3.47Å
321	N	27.6	Very low	28.8	Very low	133 Å²	133	132.1 Å²	132.1	71%	0.711	74%	0.742	S	S	*	*	S	Bend	trans	-96.2	16.8	-172.9	-64.2	-26.6	0	0	0	114.2	N318	N318-N321 PolarHBondContact O-N 3.32Å
322	A	28	Very low	30	Very low	80 Å²	80	129.7 Å²	129.7	66%	0.661	73%	0.73	S	S	*	*			trans	-105.4	-11.4	-164.7	0	0	0	0	0	116.2
323	E	29.7	Very low	30.9	Very low	191 Å²	191	125.8 Å²	125.8	89%	0.893	70%	0.704	S	S	*	*			trans	-104.8	96.3	-179.4	-71.5	-170.1	177.4	0	0	112.1	H325	E323-H325 PolarHBondContact O-N 3.34Å
324	T	26.1	Very low	31.9	Very low	130 Å²	130	124.2 Å²	124.2	80%	0.798	70%	0.698	S	S	*	*			trans	-74.8	105.5	174.7	50.2	0	0	0	0	111.5
325	H	31.1	Very low	32.9	Very low	171 Å²	171	119.6 Å²	119.6	79%	0.792	67%	0.674	S	S	*	*			trans	-144.1	126.1	162.2	-91.3	-55.6	0	0	0	113	E323 K327	E323-H325 PolarHBondContact O-N 3.34Å; H325-K327 PolarHBondContact O-N 2.87Å
326	E	27.9	Very low	33.8	Very low	184 Å²	184	124.4 Å²	124.4	86%	0.86	68%	0.677	S	S	*	*			trans	-64.2	125	-177	-55.6	155.8	130.8	0	0	111.9
327	K	29	Very low	34.5	Very low	193 Å²	193	121 Å²	121	84%	0.839	66%	0.664	S	S	*	*			trans	-156.5	164.4	168.4	-111.7	115.7	-154.1	157	0	111.3	H325	H325-K327 PolarHBondContact O-N 2.87Å
328	P	28.9	Very low	35.5	Very low	93 Å²	93	120.5 Å²	120.5	60%	0.604	66%	0.661	S	S	*	*			trans	-91.7	160.4	-132.4	34.3	-38.8	0	0	0	116	D330	P328-D330 PolarHBondContact O-N 3.13Å
329	A	33.8	Very low	36.8	Very low	116 Å²	116	116.2 Å²	116.2	96%	0.959	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	40.8	-165.7	0	0	0	0	0	116.7
330	D	39.7	Very low	38.4	Very low	147 Å²	147	115.3 Å²	115.3	79%	0.786	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.9	5	178.3	-159.8	24.8	0	0	0	113.9	P328 S332	P328-D330 PolarHBondContact O-N 3.13Å; D330-S332 PolarHBondContact O-N 3.33Å
331	T	42.5	Very low	40	Very low	104 Å²	104	113.4 Å²	113.4	64%	0.638	62%	0.62	S	S	*	*			trans	-80.9	64.8	179.4	57.5	0	0	0	0	112.5
332	S	48.6	Very low	41.1	Very low	72 Å²	72	107.4 Å²	107.4	50%	0.503	59%	0.589	S	S	.	*			trans	-67.1	130.9	175.2	72	0	0	0	0	111.8	D330 I341	D330-S332 PolarHBondContact O-N 3.33Å; S332-I341 VanDerWaalsContact CB-CG2 3.5Å
333	L	45.4	Very low	42.1	Very low	52 Å²	52	108.1 Å²	108.1	27%	0.272	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.1	125.1	-169.6	-71.3	156.8	0	0	0	110.7	I341 A342 N345 L348	L333-I341 CarbonylContact O-C 3.46Å; L333-I341 WeakPolarHBondContact O-CA 3.41Å; L333-A342 PolarHBondContact N-O 2.82Å; L333-A342 PolarHBondContact O-N 2.96Å; L333-N345 HydrophobicContact CD1-CB 4.26Å; L333-N345 VanDerWaalsContact CD1-N 3.34Å; L333-N345 WeakPolarHBondContact CD1-OD1 3.45Å; L333-L348 HydrophobicContact CB-CD2 3.98Å
334	K	45	Very low	42.9	Very low	145 Å²	145	104.5 Å²	104.5	63%	0.63	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.4	124.2	-173.4	-170	166.3	-176.3	167.2	0	113	R336 G339 V340 I341	K334-R336 PolarHBondContact O-N 3.33Å; K334-G339 VanDerWaalsContact CE-CA 3.48Å; K334-G339 WeakPolarHBondContact CE-O 3.27Å; K334-V340 WeakPolarHBondContact CA-O 3.34Å; K334-I341 HydrophobicContact CB-CG1 4.46Å; K334-I341 HydrophobicContact CD-CG1 4.4Å; K334-I341 HydrophobicContact CG-CG1 4.23Å
335	C	46.9	Very low	43.6	Very low	13 Å²	13	103.1 Å²	103.1	9%	0.088	56%	0.558	C	S	.	*			trans	-60.9	130	172.7	177.3	0	0	0	0	111.1	C337 G339 V340 L348 H351	C335-C337 PolarHBondContact SG-N 2.64Å; C335-G339 WeakPolarHBondContact O-CA 3.3Å; C335-G339 PolarHBondContact O-N 3.05Å; C335-V340 HydrophobicContact CB-CB 4.29Å; C335-V340 WeakPolarHBondContact CB-O 3.16Å; C335-V340 PolarHBondContact N-O 3.28Å; C335-L348 HydrophobicContact CB-CD1 4.01Å; C335-H351 PolarHBondContact SG-NE2 3.44Å
336	R	43.8	Very low	44.4	Very low	219 Å²	219	102.4 Å²	102.4	83%	0.826	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-19.5	-177.9	-166.8	59.6	177.6	-168.5	1.5	113.7	K334	K334-R336 PolarHBondContact O-N 3.33Å
337	C	41	Very low	45.5	Very low	71 Å²	71	96.8 Å²	96.8	48%	0.48	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-44	-176.2	-54.6	0	0	0	0	112.8	C335	C335-C337 PolarHBondContact SG-N 2.64Å
338	C	48.7	Very low	46.4	Very low	73 Å²	73	89.5 Å²	89.5	49%	0.493	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-0.8	-177.1	63.4	0	0	0	0	114.9	V340 H351 H355	C338-V340 VanDerWaalsContact C-N 3.32Å; C338-V340 PolarHBondContact O-N 3.24Å; C338-H351 VanDerWaalsContact SG-CE1 3.58Å; C338-H351 PolarHBondContact SG-NE2 3.03Å; C338-H355 VanDerWaalsContact SG-CE1 3.57Å
339	G	52.4	Low	47.1	Very low	26 Å²	26	90.7 Å²	90.7	27%	0.268	49%	0.494	S	S	.	.			trans	78.4	5.1	176.1	0	0	0	0	0	116.4	K334 C335	K334-G339 VanDerWaalsContact CE-CA 3.48Å; K334-G339 WeakPolarHBondContact CE-O 3.27Å; C335-G339 WeakPolarHBondContact O-CA 3.3Å; C335-G339 PolarHBondContact O-N 3.05Å
340	V	61.9	Low	47.9	Very low	67 Å²	67	88.6 Å²	88.6	41%	0.406	47%	0.465	S	S	.	.			trans	-54.1	138.7	170.5	167.4	0	0	0	0	110.5	K334 C335 C338	K334-V340 WeakPolarHBondContact CA-O 3.34Å; C335-V340 HydrophobicContact CB-CB 4.29Å; C335-V340 WeakPolarHBondContact CB-O 3.16Å; C335-V340 PolarHBondContact N-O 3.28Å; C338-V340 VanDerWaalsContact C-N 3.32Å; C338-V340 PolarHBondContact O-N 3.24Å
341	I	61.8	Low	48.4	Very low	102 Å²	102	83.3 Å²	83.3	52%	0.523	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.2	-179	-59.3	177	0	0	0	108.8	S332 L333 K334	S332-I341 VanDerWaalsContact CB-CG2 3.5Å; L333-I341 CarbonylContact O-C 3.46Å; L333-I341 WeakPolarHBondContact O-CA 3.41Å; K334-I341 HydrophobicContact CB-CG1 4.46Å; K334-I341 HydrophobicContact CD-CG1 4.4Å; K334-I341 HydrophobicContact CG-CG1 4.23Å
342	A	51.6	Low	48.4	Very low	6 Å²	6	79.7 Å²	79.7	5%	0.05	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.8	176.6	0	0	0	0	0	110.1	L333 E344 L347 L348	L333-A342 PolarHBondContact N-O 2.82Å; L333-A342 PolarHBondContact O-N 2.96Å; A342-E344 VanDerWaalsContact C-N 3.29Å; A342-E344 PolarHBondContact O-N 3.43Å; A342-L347 HydrophobicContact CB-CB 4.02Å; A342-L348 HydrophobicContact CB-CB 4.05Å; A342-L348 HydrophobicContact CB-CD1 4.33Å
343	P	49	Very low	48.3	Very low	95 Å²	95	81.2 Å²	81.2	62%	0.617	42%	0.418	S	S	*	.	S	Bend	trans	-74.2	-19.8	177.9	30.2	-34.5	0	0	0	113	L347	P343-L347 HydrophobicContact CG-CD1 3.81Å
344	E	46.1	Very low	48.4	Very low	115 Å²	115	82.5 Å²	82.5	54%	0.537	43%	0.425	S	S	.	.	S	Bend	trans	-138.7	151	-175	-66.2	-179.5	-166.3	0	0	112.2	A342 R346 L347 L348	A342-E344 VanDerWaalsContact C-N 3.29Å; A342-E344 PolarHBondContact O-N 3.43Å; E344-R346 PolarHBondContact O-N 3.32Å; E344-L347 PolarHBondContact O-N 2.68Å; E344-L348 PolarHBondContact O-N 2.99Å; E344-L348 VanDerWaalsContact O-N 3.16Å
345	N	40.2	Very low	48.5	Very low	102 Å²	102	77.6 Å²	77.6	55%	0.545	40%	0.404	S	S	.	.	H	α-helix	trans	-56.8	-33.7	176.7	-91.8	-36.5	0	0	0	113	L333 L347 L348 L349	L333-N345 HydrophobicContact CD1-CB 4.26Å; L333-N345 VanDerWaalsContact CD1-N 3.34Å; L333-N345 WeakPolarHBondContact CD1-OD1 3.45Å; N345-L347 PolarHBondContact O-N 3.47Å; N345-L348 PolarHBondContact O-N 2.8Å; N345-L349 WeakPolarHBondContact O-CB 3.47Å; N345-L349 VanDerWaalsContact O-CG 3.3Å; N345-L349 WeakPolarHBondContact O-CG 3.4Å; N345-L349 PolarHBondContact O-N 2.86Å
346	R	47.5	Very low	48.2	Very low	155 Å²	155	82.7 Å²	82.7	59%	0.585	43%	0.429	S	S	*	.	H	α-helix	trans	-61.7	-46.5	-179.3	-147.3	-162.5	88	-151.9	-1.1	111.5	E344 L349 E350	E344-R346 PolarHBondContact O-N 3.32Å; R346-L349 PolarHBondContact O-N 3.19Å; R346-E350 IonicContact CZ-OE1 3.18Å; R346-E350 IonicContact NE-OE1 2.69Å; R346-E350 PolarHBondContact NE-OE1 2.95Å; R346-E350 IonicContact NH2-OE1 2.79Å; R346-E350 PolarHBondContact NH2-OE1 3.14Å; R346-E350 IonicContact NH2-OE2 3.45Å; R346-E350 PolarHBondContact NH2-OE2 3.46Å; R346-E350 WeakPolarHBondContact O-CG 3.39Å; R346-E350 PolarHBondContact O-N 3.38Å
347	L	52.4	Low	48	Very low	67 Å²	67	79 Å²	79	35%	0.351	42%	0.419	S	S	.	.	H	α-helix	trans	-69.5	-34.2	178.1	-66	169.3	0	0	0	111.8	A342 P343 E344 N345 H351	A342-L347 HydrophobicContact CB-CB 4.02Å; P343-L347 HydrophobicContact CG-CD1 3.81Å; E344-L347 PolarHBondContact O-N 2.68Å; N345-L347 PolarHBondContact O-N 3.47Å; L347-H351 VanDerWaalsContact O-CB 3.27Å; L347-H351 WeakPolarHBondContact O-CB 3.47Å; L347-H351 PolarHBondContact O-N 3.3Å
348	L	47.1	Very low	48	Very low	39 Å²	39	79 Å²	79	20%	0.204	43%	0.425	C	S	.	.	H	α-helix	trans	-65.7	-37.9	172.8	-169	70.8	0	0	0	112	L333 C335 A342 E344 N345 G352	L333-L348 HydrophobicContact CB-CD2 3.98Å; C335-L348 HydrophobicContact CB-CD1 4.01Å; A342-L348 HydrophobicContact CB-CB 4.05Å; A342-L348 HydrophobicContact CB-CD1 4.33Å; E344-L348 PolarHBondContact O-N 2.99Å; E344-L348 VanDerWaalsContact O-N 3.16Å; N345-L348 PolarHBondContact O-N 2.8Å; L348-G352 PolarHBondContact O-N 3.38Å
349	L	43.6	Very low	47.7	Very low	118 Å²	118	77.5 Å²	77.5	62%	0.618	42%	0.422	S	S	*	.	H	α-helix	trans	-72.4	-40.8	176.8	-72.8	167.8	0	0	0	112.2	N345 R346 G352 Q353	N345-L349 WeakPolarHBondContact O-CB 3.47Å; N345-L349 VanDerWaalsContact O-CG 3.3Å; N345-L349 WeakPolarHBondContact O-CG 3.4Å; N345-L349 PolarHBondContact O-N 2.86Å; R346-L349 PolarHBondContact O-N 3.19Å; L349-G352 PolarHBondContact O-N 3.07Å; L349-Q353 WeakPolarHBondContact O-CG 3.42Å; L349-Q353 PolarHBondContact O-N 2.68Å
350	E	50.1	Low	47.7	Very low	72 Å²	72	78.7 Å²	78.7	34%	0.336	43%	0.426	S	S	.	.	H	α-helix	trans	-57.7	-50	171.5	-75.6	166.9	-160.6	0	0	110.6	R346 G352 Q353 D354	R346-E350 IonicContact CZ-OE1 3.18Å; R346-E350 IonicContact NE-OE1 2.69Å; R346-E350 PolarHBondContact NE-OE1 2.95Å; R346-E350 IonicContact NH2-OE1 2.79Å; R346-E350 PolarHBondContact NH2-OE1 3.14Å; R346-E350 IonicContact NH2-OE2 3.45Å; R346-E350 PolarHBondContact NH2-OE2 3.46Å; R346-E350 WeakPolarHBondContact O-CG 3.39Å; R346-E350 PolarHBondContact O-N 3.38Å; E350-G352 VanDerWaalsContact C-N 3.32Å; E350-G352 PolarHBondContact O-N 2.7Å; E350-Q353 WeakPolarHBondContact O-CB 3.32Å; E350-Q353 PolarHBondContact O-N 3.34Å; E350-Q353 VanDerWaalsContact O-N 3.14Å; E350-D354 PolarHBondContact O-N 3.25Å
351	H	50.7	Low	47.4	Very low	37 Å²	37	76 Å²	76	17%	0.171	41%	0.41	C	S	.	.	H	α-helix	trans	-59.9	-38.4	173.1	175	66.4	0	0	0	113	C335 C338 L347 Q353 D354 H355	C335-H351 PolarHBondContact SG-NE2 3.44Å; C338-H351 VanDerWaalsContact SG-CE1 3.58Å; C338-H351 PolarHBondContact SG-NE2 3.03Å; L347-H351 VanDerWaalsContact O-CB 3.27Å; L347-H351 WeakPolarHBondContact O-CB 3.47Å; L347-H351 PolarHBondContact O-N 3.3Å; H351-Q353 VanDerWaalsContact C-N 3.32Å; H351-Q353 PolarHBondContact O-N 2.75Å; H351-D354 WeakPolarHBondContact O-CB 3.42Å; H351-D354 PolarHBondContact O-N 3.37Å; H351-D354 VanDerWaalsContact O-N 3.07Å; H351-H355 AromaticContact CD2-NE2 3.78Å; H351-H355 AromaticContact CE1-NE2 3.32Å; H351-H355 PolarHBondContact CE1-NE2 3.48Å; H351-H355 VanDerWaalsContact CE1-NE2 3.32Å; H351-H355 AromaticContact NE2-CD2 3.76Å; H351-H355 AromaticContact NE2-NE2 2.97Å; H351-H355 PolarHBondContact NE2-NE2 3.39Å; H351-H355 PolarHBondContact O-CD2 3.13Å; H351-H355 VanDerWaalsContact O-CD2 3.29Å; H351-H355 PolarHBondContact O-N 2.91Å
352	G	42.4	Very low	47	Very low	28 Å²	28	72.8 Å²	72.8	29%	0.289	40%	0.395	S	S	.	.	H	α-helix	trans	-61.2	-38.4	174.6	0	0	0	0	0	113	L348 L349 E350 D354 H355 I356	L348-G352 PolarHBondContact O-N 3.38Å; L349-G352 PolarHBondContact O-N 3.07Å; E350-G352 VanDerWaalsContact C-N 3.32Å; E350-G352 PolarHBondContact O-N 2.7Å; G352-D354 PolarHBondContact O-N 3.3Å; G352-H355 PolarHBondContact O-N 3.26Å; G352-I356 PolarHBondContact O-N 3.44Å
353	Q	46.2	Very low	47	Very low	104 Å²	104	72.5 Å²	72.5	49%	0.486	39%	0.393	S	S	.	.	H	α-helix	trans	-65.8	-26.1	173.1	-67.1	174.7	14.8	0	0	112.5	L349 E350 H351 I356 K357	L349-Q353 WeakPolarHBondContact O-CG 3.42Å; L349-Q353 PolarHBondContact O-N 2.68Å; E350-Q353 WeakPolarHBondContact O-CB 3.32Å; E350-Q353 PolarHBondContact O-N 3.34Å; E350-Q353 VanDerWaalsContact O-N 3.14Å; H351-Q353 VanDerWaalsContact C-N 3.32Å; H351-Q353 PolarHBondContact O-N 2.75Å; Q353-I356 PolarHBondContact O-N 3.05Å; Q353-K357 WeakPolarHBondContact O-CB 3.4Å; Q353-K357 VanDerWaalsContact O-CG 3.22Å; Q353-K357 WeakPolarHBondContact O-CG 3.23Å; Q353-K357 PolarHBondContact O-N 3.13Å
354	D	49.4	Very low	47.1	Very low	79 Å²	79	72.1 Å²	72.1	42%	0.422	39%	0.385	S	S	.	.	H	α-helix	trans	-74.4	-30.7	178.9	-62.7	-25.4	0	0	0	112.3	E350 H351 G352 I356 K357 A358	E350-D354 PolarHBondContact O-N 3.25Å; H351-D354 WeakPolarHBondContact O-CB 3.42Å; H351-D354 PolarHBondContact O-N 3.37Å; H351-D354 VanDerWaalsContact O-N 3.07Å; G352-D354 PolarHBondContact O-N 3.3Å; D354-I356 VanDerWaalsContact C-N 3.32Å; D354-K357 IonicContact OD1-NZ 3.76Å; D354-K357 PolarHBondContact OD1-NZ 2.99Å; D354-A358 WeakPolarHBondContact O-CB 3.4Å; D354-A358 PolarHBondContact O-N 3.32Å
355	H	45.4	Very low	47.2	Very low	42 Å²	42	70.7 Å²	70.7	19%	0.194	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-41.2	166.7	-68.2	-86.9	0	0	0	111.6	C338 H351 G352 A358 G359 S360	C338-H355 VanDerWaalsContact SG-CE1 3.57Å; H351-H355 AromaticContact CD2-NE2 3.78Å; H351-H355 AromaticContact CE1-NE2 3.32Å; H351-H355 PolarHBondContact CE1-NE2 3.48Å; H351-H355 VanDerWaalsContact CE1-NE2 3.32Å; H351-H355 AromaticContact NE2-CD2 3.76Å; H351-H355 AromaticContact NE2-NE2 2.97Å; H351-H355 PolarHBondContact NE2-NE2 3.39Å; H351-H355 PolarHBondContact O-CD2 3.13Å; H351-H355 VanDerWaalsContact O-CD2 3.29Å; H351-H355 PolarHBondContact O-N 2.91Å; G352-H355 PolarHBondContact O-N 3.26Å; H355-A358 PolarHBondContact O-N 3.11Å; H355-G359 PolarHBondContact O-N 3.02Å; H355-S360 WeakPolarHBondContact O-CB 3.32Å; H355-S360 PolarHBondContact O-N 3.2Å; H355-S360 VanDerWaalsContact O-N 3.12Å; H355-S360 PolarHBondContact O-OG 3.47Å
356	I	41	Very low	47.5	Very low	120 Å²	120	67.6 Å²	67.6	62%	0.615	37%	0.367	S	S	*	.	H	α-helix	trans	-66.9	-47.6	178.5	-61.4	169.7	0	0	0	110.4	G352 Q353 D354 A358 G359	G352-I356 PolarHBondContact O-N 3.44Å; Q353-I356 PolarHBondContact O-N 3.05Å; D354-I356 VanDerWaalsContact C-N 3.32Å; I356-A358 VanDerWaalsContact C-N 3.28Å; I356-A358 PolarHBondContact O-N 3.12Å; I356-G359 PolarHBondContact O-N 2.79Å; I356-G359 VanDerWaalsContact O-N 3.1Å
357	K	39.5	Very low	47.7	Very low	140 Å²	140	69.8 Å²	69.8	61%	0.609	38%	0.38	S	S	*	.	H	α-helix	trans	-63.1	-32.2	175.7	-67.9	164.9	-154.6	153.2	0	112.7	Q353 D354 G359	Q353-K357 WeakPolarHBondContact O-CB 3.4Å; Q353-K357 VanDerWaalsContact O-CG 3.22Å; Q353-K357 WeakPolarHBondContact O-CG 3.23Å; Q353-K357 PolarHBondContact O-N 3.13Å; D354-K357 IonicContact OD1-NZ 3.76Å; D354-K357 PolarHBondContact OD1-NZ 2.99Å; K357-G359 PolarHBondContact O-N 3.14Å
358	A	41.8	Very low	47.7	Very low	72 Å²	72	68.9 Å²	68.9	60%	0.595	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	5.2	175.9	0	0	0	0	0	113.7	D354 H355 I356 S360	D354-A358 WeakPolarHBondContact O-CB 3.4Å; D354-A358 PolarHBondContact O-N 3.32Å; H355-A358 PolarHBondContact O-N 3.11Å; I356-A358 VanDerWaalsContact C-N 3.28Å; I356-A358 PolarHBondContact O-N 3.12Å; A358-S360 PolarHBondContact O-N 2.95Å
359	G	42.5	Very low	47.8	Very low	42 Å²	42	72.1 Å²	72.1	43%	0.433	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	20	178.4	0	0	0	0	0	114	H355 I356 K357 S361	H355-G359 PolarHBondContact O-N 3.02Å; I356-G359 PolarHBondContact O-N 2.79Å; I356-G359 VanDerWaalsContact O-N 3.1Å; K357-G359 PolarHBondContact O-N 3.14Å; G359-S361 PolarHBondContact O-N 3.19Å
360	S	51.1	Low	48.3	Very low	50 Å²	50	70.7 Å²	70.7	35%	0.35	39%	0.389	S	S	.	.			trans	-72.6	86.5	-173.5	-62.7	0	0	0	0	111	H355 A358 V362	H355-S360 WeakPolarHBondContact O-CB 3.32Å; H355-S360 PolarHBondContact O-N 3.2Å; H355-S360 VanDerWaalsContact O-N 3.12Å; H355-S360 PolarHBondContact O-OG 3.47Å; A358-S360 PolarHBondContact O-N 2.95Å; S360-V362 VanDerWaalsContact O-CG2 3.28Å; S360-V362 WeakPolarHBondContact O-CG2 3.2Å
361	S	56.9	Low	48.8	Very low	11 Å²	11	69 Å²	69	8%	0.077	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	143.3	169.9	76.1	0	0	0	0	109.8	G359 L371 D373	G359-S361 PolarHBondContact O-N 3.19Å; S361-L371 PolarHBondContact N-O 3.47Å; S361-L371 PolarHBondContact O-N 2.98Å; S361-L371 WeakPolarHBondContact OG-CB 3.25Å; S361-L371 PolarHBondContact OG-O 3.35Å; S361-D373 VanDerWaalsContact OG-C 3.32Å; S361-D373 PolarHBondContact OG-O 3.4Å; S361-D373 VanDerWaalsContact OG-O 3.04Å
362	V	52.3	Low	48.9	Very low	34 Å²	34	75.6 Å²	75.6	21%	0.206	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	129.9	-169.8	-165.8	0	0	0	0	111.8	S360 L364 N368	S360-V362 VanDerWaalsContact O-CG2 3.28Å; S360-V362 WeakPolarHBondContact O-CG2 3.2Å; V362-L364 PolarHBondContact O-N 3.21Å; V362-N368 VanDerWaalsContact CG1-C 3.47Å; V362-N368 VanDerWaalsContact CG1-CA 3.5Å; V362-N368 HydrophobicContact CG1-CB 3.74Å; V362-N368 WeakPolarHBondContact CG1-O 3.38Å
363	C	52.8	Low	49.6	Very low	1 Å²	1	77.3 Å²	77.3	1%	0.007	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	109.3	173.5	-174.3	0	0	0	0	111.9	C366 N368 M369 L371 L377 H380	C363-C366 HydrophobicContact CB-CB 4.09Å; C363-C366 CarbonylContact O-C 3.54Å; C363-C366 PolarHBondContact O-N 2.97Å; C363-C366 PolarHBondContact SG-N 3.27Å; C363-N368 VanDerWaalsContact O-CA 3.26Å; C363-N368 WeakPolarHBondContact O-CA 3.26Å; C363-N368 PolarHBondContact O-N 2.9Å; C363-M369 PolarHBondContact N-O 2.98Å; C363-M369 PolarHBondContact O-N 3.29Å; C363-L371 HydrophobicContact CB-CD1 4.24Å; C363-L377 HydrophobicContact CB-CD1 4.12Å; C363-H380 PolarHBondContact SG-CD2 3.27Å; C363-H380 PolarHBondContact SG-NE2 3.35Å; C363-H380 VanDerWaalsContact SG-NE2 3.4Å
364	L	50.3	Low	49.9	Very low	86 Å²	86	76.1 Å²	76.1	45%	0.45	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-35.7	176.8	-57.9	178.8	0	0	0	112.8	V362 C366 K367 N368 V409	V362-L364 PolarHBondContact O-N 3.21Å; L364-C366 VanDerWaalsContact C-N 3.32Å; L364-C366 PolarHBondContact O-N 3.04Å; L364-K367 PolarHBondContact O-N 3.42Å; L364-N368 WeakPolarHBondContact CD2-OD1 3.47Å; L364-V409 HydrophobicContact CD1-CG1 3.7Å
365	L	48.2	Very low	50.4	Low	85 Å²	85	76.6 Å²	76.6	45%	0.445	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-40.4	176.7	-59.1	175.5	0	0	0	111.3	K367 L381 H384 M406	L365-K367 VanDerWaalsContact C-N 3.26Å; L365-K367 PolarHBondContact O-N 2.81Å; L365-K367 VanDerWaalsContact O-N 3.16Å; L365-L381 HydrophobicContact CD1-CD2 4.22Å; L365-H384 HydrophobicContact CD1-CB 4.07Å; L365-M406 HydrophobicContact CD1-SD 4.18Å; L365-M406 HydrophobicContact CD2-SD 4.15Å; L365-M406 HydrophobicContact CG-SD 4.39Å
366	C	45.8	Very low	51.2	Low	38 Å²	38	76.4 Å²	76.4	26%	0.257	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	44.1	176.1	-74.4	0	0	0	0	113.1	C363 L364 N368 M369 H380 H384	C363-C366 HydrophobicContact CB-CB 4.09Å; C363-C366 CarbonylContact O-C 3.54Å; C363-C366 PolarHBondContact O-N 2.97Å; C363-C366 PolarHBondContact SG-N 3.27Å; L364-C366 VanDerWaalsContact C-N 3.32Å; L364-C366 PolarHBondContact O-N 3.04Å; C366-N368 PolarHBondContact O-N 3.16Å; C366-N368 VanDerWaalsContact O-N 3.12Å; C366-M369 HydrophobicContact CB-CB 3.8Å; C366-M369 HydrophobicContact CB-CG 3.78Å; C366-M369 VanDerWaalsContact O-CG 3.25Å; C366-M369 WeakPolarHBondContact O-CG 3.48Å; C366-M369 PolarHBondContact O-N 2.91Å; C366-H380 PolarHBondContact SG-NE2 2.82Å; C366-H384 PolarHBondContact SG-CE1 2.93Å; C366-H384 PolarHBondContact SG-NE2 3.36Å; C366-H384 VanDerWaalsContact SG-NE2 3.39Å
367	K	52.9	Low	52.1	Low	201 Å²	201	71 Å²	71	87%	0.874	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	34.1	174.8	-57.1	177.3	179.7	172.6	0	114.5	L364 L365	L364-K367 PolarHBondContact O-N 3.42Å; L365-K367 VanDerWaalsContact C-N 3.26Å; L365-K367 PolarHBondContact O-N 2.81Å; L365-K367 VanDerWaalsContact O-N 3.16Å
368	N	51.8	Low	52.7	Low	47 Å²	47	72 Å²	72	25%	0.251	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	38.6	-173	-57.1	4.3	0	0	0	114.9	V362 C363 L364 C366 P370	V362-N368 VanDerWaalsContact CG1-C 3.47Å; V362-N368 VanDerWaalsContact CG1-CA 3.5Å; V362-N368 HydrophobicContact CG1-CB 3.74Å; V362-N368 WeakPolarHBondContact CG1-O 3.38Å; C363-N368 VanDerWaalsContact O-CA 3.26Å; C363-N368 WeakPolarHBondContact O-CA 3.26Å; C363-N368 PolarHBondContact O-N 2.9Å; L364-N368 WeakPolarHBondContact CD2-OD1 3.47Å; C366-N368 PolarHBondContact O-N 3.16Å; C366-N368 VanDerWaalsContact O-N 3.12Å; N368-P370 WeakPolarHBondContact O-CD 3.21Å
369	M	49.7	Very low	53.6	Low	108 Å²	108	74.6 Å²	74.6	53%	0.532	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	122.8	168	-85.6	-68.9	-69.2	0	0	110.6	C363 C366	C363-M369 PolarHBondContact N-O 2.98Å; C363-M369 PolarHBondContact O-N 3.29Å; C366-M369 HydrophobicContact CB-CB 3.8Å; C366-M369 HydrophobicContact CB-CG 3.78Å; C366-M369 VanDerWaalsContact O-CG 3.25Å; C366-M369 WeakPolarHBondContact O-CG 3.48Å; C366-M369 PolarHBondContact O-N 2.91Å
370	P	53.9	Low	54.6	Low	88 Å²	88	74.6 Å²	74.6	57%	0.571	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	147.7	174.5	32	-34.5	0	0	0	110.7	N368	N368-P370 WeakPolarHBondContact O-CD 3.21Å
371	L	60.7	Low	54.8	Low	35 Å²	35	74.2 Å²	74.2	18%	0.183	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142.8	179.9	-67.2	172.3	0	0	0	108.8	S361 C363 D373 L377 H380	S361-L371 PolarHBondContact N-O 3.47Å; S361-L371 PolarHBondContact O-N 2.98Å; S361-L371 WeakPolarHBondContact OG-CB 3.25Å; S361-L371 PolarHBondContact OG-O 3.35Å; C363-L371 HydrophobicContact CB-CD1 4.24Å; L371-D373 VanDerWaalsContact C-N 3.3Å; L371-D373 PolarHBondContact O-N 3.35Å; L371-L377 HydrophobicContact CD1-CB 4.21Å; L371-L377 HydrophobicContact CD1-CD1 3.91Å; L371-H380 HydrophobicContact CD1-CB 3.53Å
372	H	53.7	Low	54.6	Low	177 Å²	177	80.1 Å²	80.1	82%	0.819	40%	0.399	S	S	*	.	S	Bend	trans	-63.5	-31.3	-164.2	-74.7	-73.4	0	0	0	114.8	T376	H372-T376 PolarHBondContact N-OG1 3.16Å
373	D	57.1	Low	54.9	Low	63 Å²	63	83.5 Å²	83.5	34%	0.337	42%	0.415	S	S	.	.	S	Bend	trans	-157.1	165.6	178.7	63.9	63.5	0	0	0	112.4	S361 L371 T375 T376 L377	S361-D373 VanDerWaalsContact OG-C 3.32Å; S361-D373 PolarHBondContact OG-O 3.4Å; S361-D373 VanDerWaalsContact OG-O 3.04Å; L371-D373 VanDerWaalsContact C-N 3.3Å; L371-D373 PolarHBondContact O-N 3.35Å; D373-T375 PolarHBondContact O-N 3.31Å; D373-T375 VanDerWaalsContact O-N 3.15Å; D373-T375 VanDerWaalsContact OD1-CA 3.26Å; D373-T375 WeakPolarHBondContact OD1-CA 3.3Å; D373-T375 WeakPolarHBondContact OD1-CB 3.49Å; D373-T375 PolarHBondContact OD1-N 2.83Å; D373-T375 PolarHBondContact OD1-OG1 3.46Å; D373-T376 PolarHBondContact N-OG1 2.92Å; D373-T376 VanDerWaalsContact N-OG1 3.1Å; D373-T376 PolarHBondContact O-N 2.92Å; D373-T376 PolarHBondContact O-OG1 2.97Å; D373-T376 PolarHBondContact OD1-N 3.29Å; D373-L377 PolarHBondContact O-N 3.25Å
374	D	52	Low	55	Low	79 Å²	79	87.1 Å²	87.1	42%	0.422	43%	0.432	S	S	.	.	H	α-helix	trans	-61.5	-24.6	-176.3	-151.1	64.3	0	0	0	113.7	R378	D374-R378 VanDerWaalsContact O-CD 3.26Å; D374-R378 WeakPolarHBondContact O-CD 3.46Å; D374-R378 WeakPolarHBondContact O-CG 3.39Å; D374-R378 PolarHBondContact O-N 3.2Å; D374-R378 IonicContact OD2-CZ 3.1Å; D374-R378 IonicContact OD2-NE 2.78Å; D374-R378 PolarHBondContact OD2-NE 3.4Å; D374-R378 IonicContact OD2-NH2 3.84Å; D374-R378 PolarHBondContact OD2-NH2 3.19Å
375	T	59.6	Low	54.5	Low	89 Å²	89	88.5 Å²	88.5	55%	0.546	44%	0.444	S	S	.	.	H	α-helix	trans	-71.2	-43.9	171.3	3.4	0	0	0	0	111.6	D373 L377 R378 Q379	D373-T375 PolarHBondContact O-N 3.31Å; D373-T375 VanDerWaalsContact O-N 3.15Å; D373-T375 VanDerWaalsContact OD1-CA 3.26Å; D373-T375 WeakPolarHBondContact OD1-CA 3.3Å; D373-T375 WeakPolarHBondContact OD1-CB 3.49Å; D373-T375 PolarHBondContact OD1-N 2.83Å; D373-T375 PolarHBondContact OD1-OG1 3.46Å; T375-L377 VanDerWaalsContact C-N 3.32Å; T375-L377 PolarHBondContact O-N 3.02Å; T375-R378 PolarHBondContact O-N 3.35Å; T375-Q379 WeakPolarHBondContact O-CG 3.46Å; T375-Q379 PolarHBondContact O-N 2.88Å
376	T	61.7	Low	54.2	Low	39 Å²	39	90 Å²	90	24%	0.239	45%	0.448	C	S	.	.	H	α-helix	trans	-64.4	-35.1	173.6	63.1	0	0	0	0	111.9	H372 D373 Q379 H380	H372-T376 PolarHBondContact N-OG1 3.16Å; D373-T376 PolarHBondContact N-OG1 2.92Å; D373-T376 VanDerWaalsContact N-OG1 3.1Å; D373-T376 PolarHBondContact O-N 2.92Å; D373-T376 PolarHBondContact O-OG1 2.97Å; D373-T376 PolarHBondContact OD1-N 3.29Å; T376-Q379 PolarHBondContact O-N 3.31Å; T376-H380 VanDerWaalsContact O-CB 3.23Å; T376-H380 WeakPolarHBondContact O-CB 3.1Å; T376-H380 PolarHBondContact O-N 2.86Å
377	L	60.9	Low	53.6	Low	5 Å²	5	97.4 Å²	97.4	3%	0.026	47%	0.471	C	S	.	.	H	α-helix	trans	-63	-45.2	170.2	177.3	60.5	0	0	0	112	C363 L371 D373 T375 Q379 H380 L381 L410	C363-L377 HydrophobicContact CB-CD1 4.12Å; L371-L377 HydrophobicContact CD1-CB 4.21Å; L371-L377 HydrophobicContact CD1-CD1 3.91Å; D373-L377 PolarHBondContact O-N 3.25Å; T375-L377 VanDerWaalsContact C-N 3.32Å; T375-L377 PolarHBondContact O-N 3.02Å; L377-Q379 VanDerWaalsContact C-N 3.35Å; L377-Q379 PolarHBondContact O-N 2.99Å; L377-H380 PolarHBondContact O-N 2.82Å; L377-L381 HydrophobicContact CD1-CD1 3.99Å; L377-L381 HydrophobicContact CD1-CG 4.02Å; L377-L381 HydrophobicContact CG-CD1 4.01Å; L377-L381 HydrophobicContact CG-CG 4.46Å; L377-L381 WeakPolarHBondContact O-CB 3.31Å; L377-L381 VanDerWaalsContact O-CG 3.31Å; L377-L381 WeakPolarHBondContact O-CG 3.28Å; L377-L381 PolarHBondContact O-N 3.26Å; L377-L410 HydrophobicContact CD2-CD2 3.92Å
378	R	51.2	Low	52.5	Low	162 Å²	162	93 Å²	93	61%	0.611	46%	0.456	S	S	*	.	H	α-helix	trans	-65.1	-35.8	177.6	-69.7	160.2	-165.4	-103.1	1.6	112.5	D374 T375 K382	D374-R378 VanDerWaalsContact O-CD 3.26Å; D374-R378 WeakPolarHBondContact O-CD 3.46Å; D374-R378 WeakPolarHBondContact O-CG 3.39Å; D374-R378 PolarHBondContact O-N 3.2Å; D374-R378 IonicContact OD2-CZ 3.1Å; D374-R378 IonicContact OD2-NE 2.78Å; D374-R378 PolarHBondContact OD2-NE 3.4Å; D374-R378 IonicContact OD2-NH2 3.84Å; D374-R378 PolarHBondContact OD2-NH2 3.19Å; T375-R378 PolarHBondContact O-N 3.35Å; R378-K382 PolarHBondContact O-N 3.45Å
379	Q	60.7	Low	51.6	Low	127 Å²	127	98.7 Å²	98.7	59%	0.593	48%	0.48	S	S	*	.	H	α-helix	trans	-69.1	-44.2	172	-71	177.2	0.8	0	0	111.8	T375 T376 L377 L381 K382 L383	T375-Q379 WeakPolarHBondContact O-CG 3.46Å; T375-Q379 PolarHBondContact O-N 2.88Å; T376-Q379 PolarHBondContact O-N 3.31Å; L377-Q379 VanDerWaalsContact C-N 3.35Å; L377-Q379 PolarHBondContact O-N 2.99Å; Q379-L381 VanDerWaalsContact C-N 3.35Å; Q379-L381 PolarHBondContact O-N 3.46Å; Q379-K382 WeakPolarHBondContact O-CB 3.3Å; Q379-K382 PolarHBondContact O-N 3.06Å; Q379-K382 VanDerWaalsContact O-N 3.12Å; Q379-L383 PolarHBondContact O-N 2.87Å
380	H	64	Low	50.6	Low	42 Å²	42	100.3 Å²	100.3	19%	0.194	49%	0.486	C	S	.	.	H	α-helix	trans	-62.6	-40	176.9	-178.4	83.2	0	0	0	112.3	C363 C366 L371 T376 L377 K382 L383 H384	C363-H380 PolarHBondContact SG-CD2 3.27Å; C363-H380 PolarHBondContact SG-NE2 3.35Å; C363-H380 VanDerWaalsContact SG-NE2 3.4Å; C366-H380 PolarHBondContact SG-NE2 2.82Å; L371-H380 HydrophobicContact CD1-CB 3.53Å; T376-H380 VanDerWaalsContact O-CB 3.23Å; T376-H380 WeakPolarHBondContact O-CB 3.1Å; T376-H380 PolarHBondContact O-N 2.86Å; L377-H380 PolarHBondContact O-N 2.82Å; H380-K382 VanDerWaalsContact C-N 3.28Å; H380-K382 PolarHBondContact O-N 2.92Å; H380-L383 WeakPolarHBondContact O-CB 3.17Å; H380-L383 PolarHBondContact O-N 2.83Å; H380-H384 AromaticContact CD2-CD2 3.82Å; H380-H384 AromaticContact CD2-NE2 3.53Å; H380-H384 AromaticContact CE1-NE2 3.87Å; H380-H384 AromaticContact NE2-CD2 3.77Å; H380-H384 AromaticContact NE2-NE2 3.02Å; H380-H384 PolarHBondContact NE2-NE2 3.41Å; H380-H384 PolarHBondContact O-CD2 3.21Å; H380-H384 VanDerWaalsContact O-CD2 3.32Å; H380-H384 PolarHBondContact O-N 2.97Å
381	L	54.7	Low	49.4	Very low	42 Å²	42	105.8 Å²	105.8	22%	0.22	50%	0.504	C	S	.	.	H	α-helix	trans	-64.7	-29.5	174.4	-72.5	171	0	0	0	112.6	L365 L377 Q379 L383 H384 L410	L365-L381 HydrophobicContact CD1-CD2 4.22Å; L377-L381 HydrophobicContact CD1-CD1 3.99Å; L377-L381 HydrophobicContact CD1-CG 4.02Å; L377-L381 HydrophobicContact CG-CD1 4.01Å; L377-L381 HydrophobicContact CG-CG 4.46Å; L377-L381 WeakPolarHBondContact O-CB 3.31Å; L377-L381 VanDerWaalsContact O-CG 3.31Å; L377-L381 WeakPolarHBondContact O-CG 3.28Å; L377-L381 PolarHBondContact O-N 3.26Å; Q379-L381 VanDerWaalsContact C-N 3.35Å; Q379-L381 PolarHBondContact O-N 3.46Å; L381-L383 VanDerWaalsContact C-N 3.34Å; L381-H384 PolarHBondContact O-N 3.33Å; L381-L410 HydrophobicContact CD1-CD1 4.03Å
382	K	54	Low	48	Very low	134 Å²	134	108.2 Å²	108.2	58%	0.583	54%	0.537	S	S	*	.	H	α-helix	trans	-64.7	-36.4	168.6	-71.2	179.4	177.3	-173.4	0	112.1	R378 Q379 H380 H384 V385 Q386	R378-K382 PolarHBondContact O-N 3.45Å; Q379-K382 WeakPolarHBondContact O-CB 3.3Å; Q379-K382 PolarHBondContact O-N 3.06Å; Q379-K382 VanDerWaalsContact O-N 3.12Å; H380-K382 VanDerWaalsContact C-N 3.28Å; H380-K382 PolarHBondContact O-N 2.92Å; K382-H384 PolarHBondContact O-N 2.74Å; K382-V385 CarbonylContact O-C 3.58Å; K382-V385 WeakPolarHBondContact O-CA 3.47Å; K382-V385 WeakPolarHBondContact O-CB 3.49Å; K382-V385 PolarHBondContact O-N 2.88Å; K382-Q386 WeakPolarHBondContact O-CB 3.19Å; K382-Q386 WeakPolarHBondContact O-CG 3.4Å; K382-Q386 PolarHBondContact O-N 3.04Å
383	L	58.3	Low	46.8	Very low	106 Å²	106	105.7 Å²	105.7	56%	0.555	53%	0.534	S	S	*	.	H	α-helix	trans	-64.2	-26.7	176.2	-60.2	176.3	0	0	0	113.3	Q379 H380 L381 V385 R387	Q379-L383 PolarHBondContact O-N 2.87Å; H380-L383 WeakPolarHBondContact O-CB 3.17Å; H380-L383 PolarHBondContact O-N 2.83Å; L381-L383 VanDerWaalsContact C-N 3.34Å; L383-V385 VanDerWaalsContact C-N 3.28Å; L383-R387 PolarHBondContact O-N 2.96Å
384	H	54.2	Low	45.4	Very low	77 Å²	77	111 Å²	111	36%	0.356	56%	0.557	S	S	.	*	H	α-helix	trans	-71.1	-23.5	170.5	-71.9	-86	0	0	0	113.1	L365 C366 H380 L381 K382	L365-H384 HydrophobicContact CD1-CB 4.07Å; C366-H384 PolarHBondContact SG-CE1 2.93Å; C366-H384 PolarHBondContact SG-NE2 3.36Å; C366-H384 VanDerWaalsContact SG-NE2 3.39Å; H380-H384 AromaticContact CD2-CD2 3.82Å; H380-H384 AromaticContact CD2-NE2 3.53Å; H380-H384 AromaticContact CE1-NE2 3.87Å; H380-H384 AromaticContact NE2-CD2 3.77Å; H380-H384 AromaticContact NE2-NE2 3.02Å; H380-H384 PolarHBondContact NE2-NE2 3.41Å; H380-H384 PolarHBondContact O-CD2 3.21Å; H380-H384 VanDerWaalsContact O-CD2 3.32Å; H380-H384 PolarHBondContact O-N 2.97Å; L381-H384 PolarHBondContact O-N 3.33Å; K382-H384 PolarHBondContact O-N 2.74Å
385	V	40.1	Very low	44.1	Very low	115 Å²	115	111.7 Å²	111.7	70%	0.697	57%	0.565	S	S	*	*	H	α-helix	trans	-92.6	-27	176	-178.1	0	0	0	0	111.6	K382 L383	K382-V385 CarbonylContact O-C 3.58Å; K382-V385 WeakPolarHBondContact O-CA 3.47Å; K382-V385 WeakPolarHBondContact O-CB 3.49Å; K382-V385 PolarHBondContact O-N 2.88Å; L383-V385 VanDerWaalsContact C-N 3.28Å
386	Q	41.1	Very low	42.6	Very low	116 Å²	116	113.9 Å²	113.9	54%	0.542	58%	0.578	S	S	.	*			trans	-103.3	25.3	-177.7	-61.4	-174.6	-86	0	0	113.5	K382 D388	K382-Q386 WeakPolarHBondContact O-CB 3.19Å; K382-Q386 WeakPolarHBondContact O-CG 3.4Å; K382-Q386 PolarHBondContact O-N 3.04Å; Q386-D388 PolarHBondContact O-N 3.36Å
387	R	32.6	Very low	41	Very low	194 Å²	194	116.4 Å²	116.4	73%	0.732	59%	0.593	S	S	*	*			trans	-78.8	69.6	159.7	-84.2	-160.4	70.2	174.5	0.6	109.2	L383 F389 E390	L383-R387 PolarHBondContact O-N 2.96Å; R387-F389 PolarHBondContact O-N 3.39Å; R387-E390 IonicContact NH2-OE2 2.68Å; R387-E390 PolarHBondContact NH2-OE2 2.9Å
388	D	30.2	Very low	39.6	Very low	107 Å²	107	119.9 Å²	119.9	57%	0.572	61%	0.612	S	S	*	*			trans	-62.5	119.3	174.6	-76.6	-56.4	0	0	0	110.8	Q386 E390	Q386-D388 PolarHBondContact O-N 3.36Å; D388-E390 PolarHBondContact O-N 3.26Å
389	F	32.5	Very low	38.6	Very low	168 Å²	168	114.4 Å²	114.4	74%	0.737	60%	0.598	S	S	*	*			trans	41.1	72.7	145.8	-52.6	-78.7	0	0	0	118.2	R387	R387-F389 PolarHBondContact O-N 3.39Å
390	E	29	Very low	37.1	Very low	142 Å²	142	113.7 Å²	113.7	66%	0.664	60%	0.603	S	S	*	*			trans	-79.1	129.8	143.8	-69.8	174.9	123.1	0	0	107.8	R387 D388 G392	R387-E390 IonicContact NH2-OE2 2.68Å; R387-E390 PolarHBondContact NH2-OE2 2.9Å; D388-E390 PolarHBondContact O-N 3.26Å; E390-G392 PolarHBondContact O-N 2.81Å
391	E	28.6	Very low	35.6	Very low	203 Å²	203	114.6 Å²	114.6	95%	0.949	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	120.1	-171.7	-64.7	-173.5	133.7	0	0	112.2
392	G	32.1	Very low	34.6	Very low	85 Å²	85	116.3 Å²	116.3	88%	0.876	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	116.5	-0	171.4	0	0	0	0	0	116.9	E390	E390-G392 PolarHBondContact O-N 2.81Å
393	V	28.6	Very low	33.7	Very low	124 Å²	124	115.7 Å²	115.7	75%	0.752	62%	0.622	S	S	*	*			trans	-114.9	123.5	175.5	-174.4	0	0	0	0	110.6
394	E	27.1	Very low	32.6	Very low	176 Å²	176	118.3 Å²	118.3	82%	0.822	63%	0.625	S	S	*	*			trans	-66.3	138.5	175.7	-70	-164.7	138.1	0	0	111.5	V396	E394-V396 PolarHBondContact O-N 3.5Å
395	P	25.7	Very low	31.7	Very low	92 Å²	92	118.3 Å²	118.3	60%	0.597	63%	0.633	S	S	*	*			trans	-68.3	130.4	-179	27.4	-34.1	0	0	0	111.3	V397	P395-V397 HydrophobicContact CB-CG2 4.4Å; P395-V397 HydrophobicContact CG-CG2 4.33Å; P395-V397 PolarHBondContact O-N 3.22Å
396	V	27.7	Very low	31.4	Very low	136 Å²	136	115.5 Å²	115.5	82%	0.824	61%	0.613	S	S	*	*			trans	-74.5	81.8	171.4	-176.9	0	0	0	0	108.8	E394 L398	E394-V396 PolarHBondContact O-N 3.5Å; V396-L398 PolarHBondContact O-N 3.25Å
397	V	27.7	Very low	31.1	Very low	92 Å²	92	113.2 Å²	113.2	56%	0.558	60%	0.604	S	S	*	*			trans	-68.7	100.4	175.3	-176.2	0	0	0	0	109	L79 P395 S399	L79-V397 HydrophobicContact CD1-CB 4.4Å; L79-V397 HydrophobicContact CD1-CG1 4.22Å; L79-V397 HydrophobicContact CD1-CG2 3.99Å; P395-V397 HydrophobicContact CB-CG2 4.4Å; P395-V397 HydrophobicContact CG-CG2 4.33Å; P395-V397 PolarHBondContact O-N 3.22Å; V397-S399 PolarHBondContact O-N 3.47Å
398	L	31	Very low	31.2	Very low	78 Å²	78	108.8 Å²	108.8	41%	0.408	59%	0.587	S	S	.	*			trans	-59	127.9	163.2	-68.7	170.4	0	0	0	108.3	V396 D402 M406	V396-L398 PolarHBondContact O-N 3.25Å; L398-D402 HydrophobicContact CB-CB 4.2Å; L398-D402 HydrophobicContact CD2-CB 3.99Å; L398-M406 HydrophobicContact CD1-CE 3.62Å; L398-M406 HydrophobicContact CD1-SD 4.28Å
399	S	30.1	Very low	31.4	Very low	47 Å²	47	106.7 Å²	106.7	33%	0.329	58%	0.578	S	S	.	*			trans	-65.9	160.7	174.2	74.2	0	0	0	0	110.1	V397 A401 D402 Y403	V397-S399 PolarHBondContact O-N 3.47Å; S399-A401 PolarHBondContact O-N 2.82Å; S399-A401 VanDerWaalsContact O-N 3.16Å; S399-A401 PolarHBondContact OG-N 2.69Å; S399-D402 VanDerWaalsContact CB-OD2 3.25Å; S399-D402 WeakPolarHBondContact CB-OD2 3.49Å; S399-D402 PolarHBondContact N-OD2 2.93Å; S399-D402 PolarHBondContact O-N 3.45Å; S399-D402 VanDerWaalsContact OG-CG 3.27Å; S399-D402 PolarHBondContact OG-N 3Å; S399-D402 VanDerWaalsContact OG-N 3.09Å; S399-D402 PolarHBondContact OG-OD2 3.48Å; S399-Y403 PolarHBondContact O-N 2.79Å
400	T	30	Very low	31.5	Very low	112 Å²	112	101.1 Å²	101.1	69%	0.687	56%	0.556	S	S	*	*	H	α-helix	trans	-56.8	-30	170.5	34.7	0	0	0	0	111.9	Y404	T400-Y404 WeakPolarHBondContact O-CB 3.17Å; T400-Y404 WeakPolarHBondContact O-CD2 3.2Å; T400-Y404 PolarHBondContact O-N 2.7Å
401	A	31.4	Very low	31.7	Very low	61 Å²	61	98.5 Å²	98.5	50%	0.504	54%	0.543	S	S	.	.	H	α-helix	trans	-67.4	-41.3	173.1	0	0	0	0	0	112.4	S399 Y404 C405	S399-A401 PolarHBondContact O-N 2.82Å; S399-A401 VanDerWaalsContact O-N 3.16Å; S399-A401 PolarHBondContact OG-N 2.69Å; A401-Y404 PolarHBondContact O-N 3.39Å; A401-C405 WeakPolarHBondContact O-CB 3.41Å; A401-C405 PolarHBondContact O-N 3.15Å; A401-C405 PolarHBondContact O-SG 3.12Å
402	D	34.3	Very low	32	Very low	78 Å²	78	94.4 Å²	94.4	42%	0.417	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-41.1	175.6	-58.3	-62.1	0	0	0	111.3	L398 S399 C405 M406	L398-D402 HydrophobicContact CB-CB 4.2Å; L398-D402 HydrophobicContact CD2-CB 3.99Å; S399-D402 VanDerWaalsContact CB-OD2 3.25Å; S399-D402 WeakPolarHBondContact CB-OD2 3.49Å; S399-D402 PolarHBondContact N-OD2 2.93Å; S399-D402 PolarHBondContact O-N 3.45Å; S399-D402 VanDerWaalsContact OG-CG 3.27Å; S399-D402 PolarHBondContact OG-N 3Å; S399-D402 VanDerWaalsContact OG-N 3.09Å; S399-D402 PolarHBondContact OG-OD2 3.48Å; D402-C405 WeakPolarHBondContact O-CB 3.38Å; D402-C405 PolarHBondContact O-N 3.07Å; D402-M406 WeakPolarHBondContact O-CG 3.2Å; D402-M406 PolarHBondContact O-N 3.04Å
403	Y	35.6	Very low	32.2	Very low	121 Å²	121	95.5 Å²	95.5	48%	0.475	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-47.1	174	-179.1	-104.4	0	0	0	111.9	S399 C405 M406 L407	S399-Y403 PolarHBondContact O-N 2.79Å; Y403-C405 VanDerWaalsContact C-N 3.31Å; Y403-C405 PolarHBondContact O-N 3.38Å; Y403-M406 HydrophobicContact CD2-CE 4.43Å; Y403-M406 PolarHBondContact O-N 3.22Å; Y403-L407 HydrophobicContact CD1-CD1 3.91Å; Y403-L407 HydrophobicContact CE1-CD1 3.43Å; Y403-L407 VanDerWaalsContact CE1-CD1 3.43Å; Y403-L407 HydrophobicContact CE1-CG 4.24Å; Y403-L407 WeakPolarHBondContact O-CG 3.48Å; Y403-L407 PolarHBondContact O-N 3.43Å
404	Y	34.4	Very low	32.3	Very low	160 Å²	160	94.9 Å²	94.9	63%	0.627	52%	0.518	S	S	*	.	H	α-helix	trans	-64.4	-32.7	173.2	-83.2	-64.6	0	0	0	112.7	T400 A401 L407 R408	T400-Y404 WeakPolarHBondContact O-CB 3.17Å; T400-Y404 WeakPolarHBondContact O-CD2 3.2Å; T400-Y404 PolarHBondContact O-N 2.7Å; A401-Y404 PolarHBondContact O-N 3.39Å; Y404-L407 HydrophobicContact CD1-CD1 4.4Å; Y404-R408 WeakPolarHBondContact O-CB 3.37Å; Y404-R408 PolarHBondContact O-N 2.94Å
405	C	35.5	Very low	32.6	Very low	77 Å²	77	90.9 Å²	90.9	52%	0.52	50%	0.503	S	S	.	.	H	α-helix	trans	-66.7	-43.4	172.5	-82.5	0	0	0	0	112.3	A401 D402 Y403 R408 V409	A401-C405 WeakPolarHBondContact O-CB 3.41Å; A401-C405 PolarHBondContact O-N 3.15Å; A401-C405 PolarHBondContact O-SG 3.12Å; D402-C405 WeakPolarHBondContact O-CB 3.38Å; D402-C405 PolarHBondContact O-N 3.07Å; Y403-C405 VanDerWaalsContact C-N 3.31Å; Y403-C405 PolarHBondContact O-N 3.38Å; C405-R408 PolarHBondContact O-N 2.82Å; C405-V409 WeakPolarHBondContact O-CG2 3.16Å; C405-V409 PolarHBondContact O-N 3.31Å
406	M	33.5	Very low	33	Very low	56 Å²	56	90.8 Å²	90.8	28%	0.276	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-45.6	173.7	-68	-162.5	-53.1	0	0	111.6	L365 L398 D402 Y403 R408 V409 L410	L365-M406 HydrophobicContact CD1-SD 4.18Å; L365-M406 HydrophobicContact CD2-SD 4.15Å; L365-M406 HydrophobicContact CG-SD 4.39Å; L398-M406 HydrophobicContact CD1-CE 3.62Å; L398-M406 HydrophobicContact CD1-SD 4.28Å; D402-M406 WeakPolarHBondContact O-CG 3.2Å; D402-M406 PolarHBondContact O-N 3.04Å; Y403-M406 HydrophobicContact CD2-CE 4.43Å; Y403-M406 PolarHBondContact O-N 3.22Å; M406-R408 VanDerWaalsContact C-N 3.29Å; M406-R408 PolarHBondContact O-N 2.99Å; M406-V409 PolarHBondContact O-N 3.31Å; M406-L410 WeakPolarHBondContact O-CG 3.42Å; M406-L410 PolarHBondContact O-N 3.45Å
407	L	36.7	Very low	33.3	Very low	68 Å²	68	88.3 Å²	88.3	36%	0.356	48%	0.479	S	S	.	.	H	α-helix	trans	-59.9	-38.6	173.4	-73.3	178.1	0	0	0	112	Y403 Y404 L410 H411	Y403-L407 HydrophobicContact CD1-CD1 3.91Å; Y403-L407 HydrophobicContact CE1-CD1 3.43Å; Y403-L407 VanDerWaalsContact CE1-CD1 3.43Å; Y403-L407 HydrophobicContact CE1-CG 4.24Å; Y403-L407 WeakPolarHBondContact O-CG 3.48Å; Y403-L407 PolarHBondContact O-N 3.43Å; Y404-L407 HydrophobicContact CD1-CD1 4.4Å; L407-L410 PolarHBondContact O-N 3.14Å; L407-H411 WeakPolarHBondContact O-CB 3.46Å; L407-H411 PolarHBondContact O-N 3.49Å
408	R	33.8	Very low	33.6	Very low	102 Å²	102	88.1 Å²	88.1	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-68.4	-31.3	177.8	-168.4	174.7	-174.1	-172.4	0.9	112.5	Y404 C405 M406 L412	Y404-R408 WeakPolarHBondContact O-CB 3.37Å; Y404-R408 PolarHBondContact O-N 2.94Å; C405-R408 PolarHBondContact O-N 2.82Å; M406-R408 VanDerWaalsContact C-N 3.29Å; M406-R408 PolarHBondContact O-N 2.99Å; R408-L412 HydrophobicContact CG-CD1 4.27Å; R408-L412 WeakPolarHBondContact O-CB 3.49Å; R408-L412 WeakPolarHBondContact O-CD1 3.17Å; R408-L412 WeakPolarHBondContact O-CG 3.43Å; R408-L412 PolarHBondContact O-N 2.82Å; R408-L412 VanDerWaalsContact O-N 3.15Å
409	V	34.3	Very low	33.7	Very low	62 Å²	62	88.7 Å²	88.7	38%	0.376	48%	0.479	S	S	.	.	H	α-helix	trans	-67.8	-48.5	170.5	173.9	0	0	0	0	110.5	L364 C405 M406 H411 L412 Q413	L364-V409 HydrophobicContact CD1-CG1 3.7Å; C405-V409 WeakPolarHBondContact O-CG2 3.16Å; C405-V409 PolarHBondContact O-N 3.31Å; M406-V409 PolarHBondContact O-N 3.31Å; V409-H411 VanDerWaalsContact C-N 3.29Å; V409-H411 PolarHBondContact O-N 3.24Å; V409-L412 PolarHBondContact O-N 3.11Å; V409-L412 VanDerWaalsContact O-N 3.09Å; V409-Q413 WeakPolarHBondContact O-CG 3.4Å; V409-Q413 PolarHBondContact O-N 3.47Å; V409-Q413 VanDerWaalsContact O-N 3.14Å
410	L	34.3	Very low	34	Very low	51 Å²	51	91.5 Å²	91.5	27%	0.267	49%	0.489	S	S	.	.	H	α-helix	trans	-60.4	-38.6	176.7	-65.5	170	0	0	0	112	L377 L381 M406 L407 L412 Q413 A414	L377-L410 HydrophobicContact CD2-CD2 3.92Å; L381-L410 HydrophobicContact CD1-CD1 4.03Å; M406-L410 WeakPolarHBondContact O-CG 3.42Å; M406-L410 PolarHBondContact O-N 3.45Å; L407-L410 PolarHBondContact O-N 3.14Å; L410-L412 VanDerWaalsContact C-N 3.25Å; L410-L412 PolarHBondContact O-N 3.32Å; L410-Q413 PolarHBondContact O-N 3Å; L410-Q413 VanDerWaalsContact O-N 3.15Å; L410-A414 PolarHBondContact O-N 3.33Å
411	H	33.6	Very low	34.3	Very low	87 Å²	87	90 Å²	90	40%	0.403	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	9.9	178.9	-155.1	51.9	0	0	0	114	R235 L407 V409	R235-H411 PolarHBondContact NH2-CD2 2.87Å; R235-H411 PolarHBondContact NH2-CE1 2.88Å; R235-H411 PolarHBondContact NH2-NE2 3.03Å; L407-H411 WeakPolarHBondContact O-CB 3.46Å; L407-H411 PolarHBondContact O-N 3.49Å; V409-H411 VanDerWaalsContact C-N 3.29Å; V409-H411 PolarHBondContact O-N 3.24Å
412	L	35.6	Very low	34.5	Very low	118 Å²	118	92.2 Å²	92.2	62%	0.618	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-4.9	162.4	-74	169	0	0	0	111.8	R408 V409 L410	R408-L412 HydrophobicContact CG-CD1 4.27Å; R408-L412 WeakPolarHBondContact O-CB 3.49Å; R408-L412 WeakPolarHBondContact O-CD1 3.17Å; R408-L412 WeakPolarHBondContact O-CG 3.43Å; R408-L412 PolarHBondContact O-N 2.82Å; R408-L412 VanDerWaalsContact O-N 3.15Å; V409-L412 PolarHBondContact O-N 3.11Å; V409-L412 VanDerWaalsContact O-N 3.09Å; L410-L412 VanDerWaalsContact C-N 3.25Å; L410-L412 PolarHBondContact O-N 3.32Å
413	Q	34.9	Very low	34.5	Very low	107 Å²	107	93.4 Å²	93.4	50%	0.5	48%	0.477	S	S	.	.			trans	-100.1	-4.8	173.7	-70.9	173.4	-41.8	0	0	112.5	V409 L410	V409-Q413 WeakPolarHBondContact O-CG 3.4Å; V409-Q413 PolarHBondContact O-N 3.47Å; V409-Q413 VanDerWaalsContact O-N 3.14Å; L410-Q413 PolarHBondContact O-N 3Å; L410-Q413 VanDerWaalsContact O-N 3.15Å
414	A	31.9	Very low	34.4	Very low	112 Å²	112	90.9 Å²	90.9	93%	0.926	48%	0.478	S	S	*	.			trans	-131.5	0	176.3	0	0	0	0	0	110.9	L410	L410-A414 PolarHBondContact O-N 3.33Å

Retrieved 414 of 414 residues in 518.7 ms (Link to these results)

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