A0A077ZHG6_TRITR Loading...

Histone H3

AlphaFold DB , UniProt , Accession A0A077ZHG6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 234 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	54.2	Low	56.6	Low	213 Å²	213	137.5 Å²	137.5	100%	1.049	70%	0.699	S	S	*	*				0	-3.4	0	-77	-69.9	173.1	0	0	115
2	A	54.3	Low	56.2	Low	86 Å²	86	130.3 Å²	130.3	71%	0.711	69%	0.685	S	S	*	*			trans	-90.1	-28.2	-179.3	0	0	0	0	0	115	T4	A2-T4 PolarHBondContact O-N 3.15Å
3	L	55.8	Low	56.1	Low	156 Å²	156	126.1 Å²	126.1	82%	0.817	67%	0.672	S	S	*	*	H	α-helix	trans	-74.3	-24.6	-174.6	-77.4	155.3	0	0	0	114.2
4	T	59.7	Low	55.7	Low	85 Å²	85	131.8 Å²	131.8	52%	0.521	68%	0.68	S	S	.	*	H	α-helix	trans	-80.9	-19.1	-178.2	44.7	0	0	0	0	114.1	A2 T7	A2-T4 PolarHBondContact O-N 3.15Å; T4-T7 PolarHBondContact O-OG1 2.67Å; T4-T7 VanDerWaalsContact O-OG1 3.14Å
5	K	58	Low	55.3	Low	152 Å²	152	137.1 Å²	137.1	66%	0.661	69%	0.688	S	S	*	*	H	α-helix	trans	-79.6	-27.6	176.2	-74.2	-176.8	177.6	179.9	0	112.7	R9	K5-R9 PolarHBondContact O-N 2.82Å
6	K	60.2	Low	55	Low	158 Å²	158	133.6 Å²	133.6	69%	0.687	68%	0.68	S	S	*	*	H	α-helix	trans	-76	-33.5	-178.2	-141.5	173.9	-174.2	-179.3	0	112.1	L10	K6-L10 PolarHBondContact O-N 3.43Å
7	T	57.7	Low	54.8	Low	79 Å²	79	137 Å²	137	49%	0.485	68%	0.683	S	S	.	*	H	α-helix	trans	-70.7	-40.8	175.2	50	0	0	0	0	112.4	T4 R9 L10 L11	T4-T7 PolarHBondContact O-OG1 2.67Å; T4-T7 VanDerWaalsContact O-OG1 3.14Å; T7-R9 VanDerWaalsContact C-N 3.33Å; T7-R9 PolarHBondContact O-N 3.29Å; T7-L10 PolarHBondContact O-N 2.96Å; T7-L11 VanDerWaalsContact O-CD1 3.26Å; T7-L11 WeakPolarHBondContact O-CD1 3.34Å; T7-L11 PolarHBondContact O-N 3.27Å; T7-L11 VanDerWaalsContact O-N 3.15Å
8	L	55.7	Low	54.3	Low	135 Å²	135	132.9 Å²	132.9	71%	0.707	67%	0.669	S	S	*	*	H	α-helix	trans	-65.2	-33.4	174.8	-90.2	156.4	0	0	0	113.2	G12	L8-G12 PolarHBondContact O-N 3.29Å
9	R	55.1	Low	54.2	Low	203 Å²	203	128.9 Å²	128.9	77%	0.766	66%	0.659	S	S	*	*	H	α-helix	trans	-74.8	-30.3	178.4	-144.9	178.7	-81	-177	-6.8	112.6	K5 T7	K5-R9 PolarHBondContact O-N 2.82Å; T7-R9 VanDerWaalsContact C-N 3.33Å; T7-R9 PolarHBondContact O-N 3.29Å
10	L	56.7	Low	54.1	Low	117 Å²	117	125.3 Å²	125.3	61%	0.613	65%	0.645	S	S	*	*	H	α-helix	trans	-77.1	-31.5	175.5	-80.4	161.9	0	0	0	113.4	K6 T7	K6-L10 PolarHBondContact O-N 3.43Å; T7-L10 PolarHBondContact O-N 2.96Å
11	L	54.8	Low	54	Low	129 Å²	129	125.9 Å²	125.9	68%	0.675	65%	0.646	S	S	*	*	H	α-helix	trans	-73.3	-29.1	173.6	-91	109.1	0	0	0	113.1	T7	T7-L11 VanDerWaalsContact O-CD1 3.26Å; T7-L11 WeakPolarHBondContact O-CD1 3.34Å; T7-L11 PolarHBondContact O-N 3.27Å; T7-L11 VanDerWaalsContact O-N 3.15Å
12	G	52.9	Low	53.8	Low	51 Å²	51	119.9 Å²	119.9	53%	0.526	62%	0.621	S	S	.	*	H	α-helix	trans	-67.5	-37.3	174.5	0	0	0	0	0	113.7	L8	L8-G12 PolarHBondContact O-N 3.29Å
13	S	54	Low	53.7	Low	75 Å²	75	118.7 Å²	118.7	52%	0.524	61%	0.608	S	S	.	*	H	α-helix	trans	-78.7	-19.7	179.5	-86.9	0	0	0	0	114.8	S16	S13-S16 PolarHBondContact O-OG 2.97Å
14	R	51.1	Low	53.5	Low	206 Å²	206	117 Å²	117	78%	0.777	60%	0.596	S	S	*	*	H	α-helix	trans	-80.6	-25.5	176.4	-81.8	-174.9	172.7	-171	-2.2	113.2
15	R	49.6	Very low	53.1	Low	212 Å²	212	118.5 Å²	118.5	80%	0.8	60%	0.599	S	S	*	*	H	α-helix	trans	-77.2	-24.8	-177.6	-122.1	176.4	-177.9	-157.3	-1.5	114.1	S18	R15-S18 PolarHBondContact O-OG 2.68Å
16	S	50	Low	52.8	Low	80 Å²	80	118.2 Å²	118.2	56%	0.559	60%	0.601	S	S	*	*	H	α-helix	trans	-81.9	-24.2	175.5	61.1	0	0	0	0	113.4	S13 S20	S13-S16 PolarHBondContact O-OG 2.97Å; S16-S20 PolarHBondContact O-OG 2.87Å
17	R	52	Low	52.5	Low	192 Å²	192	118 Å²	118	73%	0.725	60%	0.602	S	S	*	*	H	α-helix	trans	-83.3	-25.2	178.7	-70.5	-176.5	177.8	-175.4	-1	113.9	S20	R17-S20 PolarHBondContact O-OG 3.12Å
18	S	46.7	Very low	52.4	Low	63 Å²	63	122.5 Å²	122.5	44%	0.441	62%	0.615	S	S	.	*	H	α-helix	trans	-79	-28.8	176.5	62.8	0	0	0	0	112.9	R15 T22	R15-S18 PolarHBondContact O-OG 2.68Å; S18-T22 WeakPolarHBondContact O-CG2 3.47Å; S18-T22 PolarHBondContact O-N 3.28Å; S18-T22 PolarHBondContact O-OG1 3.44Å; S18-T22 VanDerWaalsContact O-OG1 3.12Å
19	A	50.7	Low	52	Low	58 Å²	58	123 Å²	123	48%	0.479	62%	0.617	S	S	.	*	H	α-helix	trans	-73.4	-29.4	179.5	0	0	0	0	0	113.1	T22 S23	A19-T22 WeakPolarHBondContact CA-OG1 3.42Å; A19-T22 PolarHBondContact O-OG1 3.42Å; A19-S23 PolarHBondContact O-N 3.09Å
20	S	53.2	Low	51.5	Low	55 Å²	55	123.4 Å²	123.4	39%	0.385	62%	0.621	S	S	.	*	H	α-helix	trans	-82	-25.7	177.3	45.1	0	0	0	0	113.5	S16 R17 Q24	S16-S20 PolarHBondContact O-OG 2.87Å; R17-S20 PolarHBondContact O-OG 3.12Å; S20-Q24 VanDerWaalsContact O-CG 3.29Å; S20-Q24 WeakPolarHBondContact O-CG 3.28Å; S20-Q24 PolarHBondContact O-N 3.23Å
21	Q	50.9	Low	50.8	Low	139 Å²	139	120.6 Å²	120.6	65%	0.65	62%	0.62	S	S	*	*	H	α-helix	trans	-77.9	-29.6	171.7	-76.8	-174	-21	0	0	112.8	L25	Q21-L25 PolarHBondContact O-N 3.2Å
22	T	51.8	Low	50.3	Low	86 Å²	86	123.8 Å²	123.8	53%	0.528	63%	0.628	S	S	.	*	H	α-helix	trans	-73.6	-36.2	175.9	48.8	0	0	0	0	112.4	S18 A19 L25 E26	S18-T22 WeakPolarHBondContact O-CG2 3.47Å; S18-T22 PolarHBondContact O-N 3.28Å; S18-T22 PolarHBondContact O-OG1 3.44Å; S18-T22 VanDerWaalsContact O-OG1 3.12Å; A19-T22 WeakPolarHBondContact CA-OG1 3.42Å; A19-T22 PolarHBondContact O-OG1 3.42Å; T22-L25 PolarHBondContact O-N 3.29Å; T22-E26 PolarHBondContact O-N 3.42Å; T22-E26 VanDerWaalsContact O-N 3.17Å
23	S	52.3	Low	49.7	Very low	62 Å²	62	129.2 Å²	129.2	43%	0.434	65%	0.645	S	S	.	*	H	α-helix	trans	-72.2	-31.4	176.4	84.9	0	0	0	0	112.8	A19 L25 E26 E27	A19-S23 PolarHBondContact O-N 3.09Å; S23-L25 VanDerWaalsContact C-N 3.31Å; S23-L25 PolarHBondContact O-N 3.49Å; S23-E26 PolarHBondContact O-N 3.13Å; S23-E27 PolarHBondContact O-N 3.07Å; S23-E27 VanDerWaalsContact O-N 3.13Å
24	Q	51.2	Low	49	Very low	121 Å²	121	134.3 Å²	134.3	57%	0.565	66%	0.66	S	S	*	*	H	α-helix	trans	-76.6	-14.8	176.9	-70.8	-177.5	15.1	0	0	113.8	S20 K28	S20-Q24 VanDerWaalsContact O-CG 3.29Å; S20-Q24 WeakPolarHBondContact O-CG 3.28Å; S20-Q24 PolarHBondContact O-N 3.23Å; Q24-K28 WeakPolarHBondContact O-CG 3.35Å
25	L	50.1	Low	48.7	Very low	115 Å²	115	134.9 Å²	134.9	60%	0.602	66%	0.662	S	S	*	*	H	α-helix	trans	-92.2	-29.8	171.1	-79.4	171.9	0	0	0	112.5	Q21 T22 S23 K28	Q21-L25 PolarHBondContact O-N 3.2Å; T22-L25 PolarHBondContact O-N 3.29Å; S23-L25 VanDerWaalsContact C-N 3.31Å; S23-L25 PolarHBondContact O-N 3.49Å; L25-K28 PolarHBondContact O-N 3.19Å
26	E	51.6	Low	48.4	Very low	147 Å²	147	135.7 Å²	135.7	69%	0.687	67%	0.665	S	S	*	*	H	α-helix	trans	-73.7	-35.5	173.2	-77.4	-170.6	146.1	0	0	112.9	T22 S23 K28 L29 Y30	T22-E26 PolarHBondContact O-N 3.42Å; T22-E26 VanDerWaalsContact O-N 3.17Å; S23-E26 PolarHBondContact O-N 3.13Å; E26-K28 PolarHBondContact O-N 2.86Å; E26-L29 PolarHBondContact O-N 3.01Å; E26-Y30 PolarHBondContact O-N 3.36Å; E26-Y30 VanDerWaalsContact O-N 3.15Å
27	E	54	Low	48	Very low	153 Å²	153	142.6 Å²	142.6	72%	0.715	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-20.6	173	-87.8	-164.8	146.7	0	0	113.8	S23	S23-E27 PolarHBondContact O-N 3.07Å; S23-E27 VanDerWaalsContact O-N 3.13Å
28	K	55.4	Low	47.2	Very low	173 Å²	173	140.3 Å²	140.3	75%	0.752	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-15	177.3	-75.7	-177.9	-179.2	179.8	0	113.9	Q24 L25 E26	Q24-K28 WeakPolarHBondContact O-CG 3.35Å; L25-K28 PolarHBondContact O-N 3.19Å; E26-K28 PolarHBondContact O-N 2.86Å
29	L	48.5	Very low	47	Very low	146 Å²	146	143.2 Å²	143.2	76%	0.764	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-18.8	-180	-70.4	174.6	0	0	0	113.3	E26	E26-L29 PolarHBondContact O-N 3.01Å
30	Y	45	Very low	46.5	Very low	212 Å²	212	151.9 Å²	151.9	83%	0.831	72%	0.722	S	S	*	*	S	Bend	trans	-123.7	68.5	174.2	-83.9	-94.1	0	0	0	110.3	E26 K32	E26-Y30 PolarHBondContact O-N 3.36Å; E26-Y30 VanDerWaalsContact O-N 3.15Å; Y30-K32 PolarHBondContact O-N 3.36Å
31	G	41.3	Very low	46.1	Very low	58 Å²	58	154.5 Å²	154.5	60%	0.598	74%	0.738	S	S	*	*			trans	-70.9	112.9	173.1	0	0	0	0	0	111.7
32	K	44	Very low	45.6	Very low	195 Å²	195	152.3 Å²	152.3	85%	0.848	74%	0.738	S	S	*	*			trans	23.2	101.9	143.6	-70.1	173.7	176.5	172.2	0	116.7	Y30	Y30-K32 PolarHBondContact O-N 3.36Å
33	D	40	Very low	45.2	Very low	165 Å²	165	156.6 Å²	156.6	88%	0.882	75%	0.749	S	S	*	*			trans	-139.8	74.4	150.3	-86.4	-38.1	0	0	0	110.7
34	H	40.1	Very low	44.6	Very low	183 Å²	183	161.7 Å²	161.7	85%	0.847	77%	0.766	S	S	*	*			trans	-86.4	108.9	150.1	-80.3	-34.3	0	0	0	107.4
35	R	44	Very low	43.9	Very low	217 Å²	217	160.7 Å²	160.7	82%	0.819	77%	0.773	S	S	*	*			trans	161.3	132.8	134.5	-89.3	167.8	-152	-152	7	111.5
36	R	43.7	Very low	43.5	Very low	229 Å²	229	160.7 Å²	160.7	86%	0.864	78%	0.782	S	S	*	*			trans	90.4	105.3	146.5	-68.8	169.8	-177.2	-148.7	-0.2	118.3
37	R	41	Very low	42.8	Very low	225 Å²	225	159 Å²	159	85%	0.849	79%	0.786	S	S	*	*			trans	-57.4	159.8	155.3	-66.9	177.3	175.9	-169.1	-2.2	112
38	D	36.8	Very low	42.2	Very low	144 Å²	144	161.4 Å²	161.4	77%	0.77	79%	0.794	S	S	*	*			trans	97.2	131.4	148.9	-56.9	-35.8	0	0	0	119.6
39	S	42.4	Very low	41.1	Very low	125 Å²	125	159 Å²	159	87%	0.874	80%	0.799	S	S	*	*			trans	94	104.1	160.2	66.3	0	0	0	0	120.7
40	R	39.9	Very low	40.7	Very low	239 Å²	239	158 Å²	158	90%	0.902	80%	0.799	S	S	*	*			trans	-62.8	-178.6	154.6	-98.9	-177.1	175.7	-164.8	-0.1	111.5
41	P	44.2	Very low	40.3	Very low	111 Å²	111	156.8 Å²	156.8	72%	0.721	80%	0.798	S	S	*	*			cis	-140.7	-168.8	-31.3	37	-16.6	0	0	0	114.2
42	S	40.8	Very low	39.9	Very low	92 Å²	92	159 Å²	159	64%	0.643	81%	0.811	S	S	*	*			trans	99	113.3	141.6	-179.1	0	0	0	0	122.1
43	K	42.8	Very low	39.5	Very low	176 Å²	176	160.2 Å²	160.2	77%	0.765	81%	0.81	S	S	*	*			trans	52.4	115.9	138.7	-56.8	177.3	-176.6	-179.4	0	120.3
44	H	40.6	Very low	39.6	Very low	169 Å²	169	157.2 Å²	157.2	78%	0.782	80%	0.802	S	S	*	*				173.7	137.4	104.1	-96.8	-72.6	0	0	0	112.8
45	S	36.2	Very low	39.7	Very low	101 Å²	101	155.8 Å²	155.8	71%	0.706	80%	0.8	S	S	*	*			trans	-4	132.1	153.4	51.8	0	0	0	0	119.6
46	S	42.1	Very low	39.7	Very low	114 Å²	114	154.5 Å²	154.5	80%	0.797	80%	0.801	S	S	*	*				171.3	115.1	126.2	171.1	0	0	0	0	111.1
47	S	35.8	Very low	39.6	Very low	111 Å²	111	146.1 Å²	146.1	78%	0.776	79%	0.786	S	S	*	*			trans	-21.9	129.5	161	-48.1	0	0	0	0	116.3
48	K	41.9	Very low	39.6	Very low	204 Å²	204	143.1 Å²	143.1	89%	0.887	79%	0.787	S	S	*	*			trans	-160.5	123.9	145.8	-106.8	162.8	-169.3	179.9	0	111.4
49	S	32.4	Very low	39.9	Very low	122 Å²	122	141.2 Å²	141.2	85%	0.853	78%	0.784	S	S	*	*			trans	-33.2	122.8	167.8	-177.6	0	0	0	0	114.5
50	V	39	Very low	40.2	Very low	126 Å²	126	140.1 Å²	140.1	76%	0.764	77%	0.773	S	S	*	*			trans	-133.5	95.8	164.2	-177.3	0	0	0	0	109.5
51	K	37.1	Very low	40.6	Very low	187 Å²	187	131.9 Å²	131.9	81%	0.813	75%	0.751	S	S	*	*			trans	6.7	118.1	143.6	-152.7	143.8	-177.5	169.5	0	116.1	R53	K51-R53 PolarHBondContact O-N 3.35Å; K51-R53 VanDerWaalsContact O-N 3.12Å
52	A	33.5	Very low	41.2	Very low	104 Å²	104	129.3 Å²	129.3	86%	0.86	73%	0.734	S	S	*	*			trans	-36.3	110.5	170.4	0	0	0	0	0	112.7
53	R	35.9	Very low	41.7	Very low	221 Å²	221	127.3 Å²	127.3	83%	0.834	72%	0.722	S	S	*	*			trans	-90.6	114	163.9	-78.3	-176.1	168.3	-146.4	-1.8	107.4	K51 D55	K51-R53 PolarHBondContact O-N 3.35Å; K51-R53 VanDerWaalsContact O-N 3.12Å; R53-D55 PolarHBondContact O-N 3.44Å
54	S	40.9	Very low	42.2	Very low	101 Å²	101	121.5 Å²	121.5	71%	0.706	70%	0.704	S	S	*	*			trans	-54.2	98.9	165.1	154.8	0	0	0	0	109	K56	S54-K56 VanDerWaalsContact C-N 3.28Å; S54-K56 PolarHBondContact O-N 2.74Å
55	D	42.7	Very low	43.1	Very low	154 Å²	154	117 Å²	117	82%	0.824	69%	0.688	S	S	*	*			trans	-63.3	92.3	165.3	-77.6	-30.5	0	0	0	108.5	R53 G57	R53-D55 PolarHBondContact O-N 3.44Å; D55-G57 PolarHBondContact O-N 2.81Å
56	K	44.7	Very low	44.4	Very low	189 Å²	189	117.3 Å²	117.3	82%	0.822	68%	0.681	S	S	*	*			trans	-67.6	74.2	153	-71.4	-178.1	-179.3	176.5	0	106.2	S54 N58	S54-K56 VanDerWaalsContact C-N 3.28Å; S54-K56 PolarHBondContact O-N 2.74Å; K56-N58 PolarHBondContact O-N 2.96Å
57	G	39.9	Very low	45.2	Very low	54 Å²	54	118.1 Å²	118.1	56%	0.557	67%	0.672	S	S	*	*			trans	-54.1	129	172.1	0	0	0	0	0	107.8	D55 S59	D55-G57 PolarHBondContact O-N 2.81Å; G57-S59 PolarHBondContact O-N 3.29Å
58	N	41.8	Very low	46.5	Very low	161 Å²	161	116.6 Å²	116.6	86%	0.861	66%	0.658	S	S	*	*			trans	-53.9	79.2	163.7	-82.7	-10.9	0	0	0	108.8	K56 V60	K56-N58 PolarHBondContact O-N 2.96Å; N58-V60 PolarHBondContact O-N 2.77Å
59	S	42.9	Very low	47.4	Very low	104 Å²	104	112.1 Å²	112.1	73%	0.727	64%	0.639	S	S	*	*			trans	-68.1	96.7	158	60.5	0	0	0	0	104.1	G57 S61	G57-S59 PolarHBondContact O-N 3.29Å; S59-S61 PolarHBondContact O-N 3.48Å
60	V	50	Low	48.7	Very low	103 Å²	103	109.6 Å²	109.6	62%	0.624	62%	0.62	S	S	*	*			trans	-55.6	96.5	163.4	-176.4	0	0	0	0	104.5	N58 V62 V65	N58-V60 PolarHBondContact O-N 2.77Å; V60-V62 PolarHBondContact O-N 3.15Å; V60-V65 HydrophobicContact CG1-CG2 3.96Å
61	S	48.3	Very low	49.8	Very low	65 Å²	65	107.8 Å²	107.8	46%	0.455	61%	0.61	S	S	.	*			trans	-57.8	137.5	-174.3	174	0	0	0	0	106.8	S59 A63 S64 V65	S59-S61 PolarHBondContact O-N 3.48Å; S61-A63 CarbonylContact O-C 3.59Å; S61-A63 PolarHBondContact O-N 3.38Å; S61-A63 WeakPolarHBondContact OG-CB 3.31Å; S61-A63 PolarHBondContact OG-N 3.34Å; S61-S64 WeakPolarHBondContact O-CA 3.47Å; S61-S64 WeakPolarHBondContact O-CB 3.33Å; S61-S64 PolarHBondContact O-N 2.73Å; S61-V65 PolarHBondContact O-N 3.12Å
62	V	55.6	Low	50.9	Low	58 Å²	58	104.1 Å²	104.1	35%	0.352	60%	0.597	S	S	.	*	H	α-helix	trans	-48.5	-30.6	172.2	-178.4	0	0	0	0	110.3	V60 V65 I66 I187	V60-V62 PolarHBondContact O-N 3.15Å; V62-V65 PolarHBondContact O-N 3.14Å; V62-I66 HydrophobicContact CG1-CD1 3.81Å; V62-I66 HydrophobicContact CG1-CG1 4.37Å; V62-I66 VanDerWaalsContact O-CG1 3.28Å; V62-I66 WeakPolarHBondContact O-CG1 3.28Å; V62-I66 PolarHBondContact O-N 3.23Å; V62-I187 HydrophobicContact CB-CG2 4.4Å; V62-I187 HydrophobicContact CG1-CG2 3.58Å; V62-I187 HydrophobicContact CG2-CD1 4.46Å; V62-I187 HydrophobicContact CG2-CG2 3.84Å
63	A	51.5	Low	52.1	Low	49 Å²	49	101.6 Å²	101.6	41%	0.405	58%	0.576	S	S	.	*	H	α-helix	trans	-58.1	-43.2	171.6	0	0	0	0	0	113.5	S61 V65 I66 E67	S61-A63 CarbonylContact O-C 3.59Å; S61-A63 PolarHBondContact O-N 3.38Å; S61-A63 WeakPolarHBondContact OG-CB 3.31Å; S61-A63 PolarHBondContact OG-N 3.34Å; A63-V65 PolarHBondContact O-N 3.32Å; A63-I66 PolarHBondContact O-N 3.29Å; A63-E67 VanDerWaalsContact O-CB 3.28Å; A63-E67 WeakPolarHBondContact O-CB 3.16Å; A63-E67 VanDerWaalsContact O-CG 3.31Å; A63-E67 WeakPolarHBondContact O-CG 3.41Å; A63-E67 PolarHBondContact O-N 3.12Å
64	S	53.4	Low	52.9	Low	54 Å²	54	95.7 Å²	95.7	38%	0.378	56%	0.56	S	S	.	*	H	α-helix	trans	-65.9	-37.4	178.7	178.7	0	0	0	0	112.3	S61 T68	S61-S64 WeakPolarHBondContact O-CA 3.47Å; S61-S64 WeakPolarHBondContact O-CB 3.33Å; S61-S64 PolarHBondContact O-N 2.73Å; S64-T68 WeakPolarHBondContact O-CB 3.48Å; S64-T68 PolarHBondContact O-N 3.19Å; S64-T68 PolarHBondContact O-OG1 3.33Å
65	V	60.4	Low	53.7	Low	74 Å²	74	93.8 Å²	93.8	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-69.9	-41.9	176.4	-176.8	0	0	0	0	110.8	V60 S61 V62 A63 T68 F69	V60-V65 HydrophobicContact CG1-CG2 3.96Å; S61-V65 PolarHBondContact O-N 3.12Å; V62-V65 PolarHBondContact O-N 3.14Å; A63-V65 PolarHBondContact O-N 3.32Å; V65-T68 PolarHBondContact O-N 3.42Å; V65-F69 WeakPolarHBondContact O-CB 3.46Å; V65-F69 PolarHBondContact O-N 3.49Å
66	I	63	Low	54.4	Low	108 Å²	108	92.5 Å²	92.5	55%	0.554	53%	0.532	S	S	*	.	H	α-helix	trans	-65.6	-42.7	175.4	-67.4	170.3	0	0	0	110.9	V62 A63 F69 C70	V62-I66 HydrophobicContact CG1-CD1 3.81Å; V62-I66 HydrophobicContact CG1-CG1 4.37Å; V62-I66 VanDerWaalsContact O-CG1 3.28Å; V62-I66 WeakPolarHBondContact O-CG1 3.28Å; V62-I66 PolarHBondContact O-N 3.23Å; A63-I66 PolarHBondContact O-N 3.29Å; I66-F69 PolarHBondContact O-N 2.95Å; I66-C70 WeakPolarHBondContact O-CB 3.4Å; I66-C70 PolarHBondContact O-N 3.3Å
67	E	58.5	Low	54.8	Low	132 Å²	132	90 Å²	90	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-62.9	-44.5	176.4	-81.4	-179.8	175.7	0	0	111.4	A63 F69 C70 V71	A63-E67 VanDerWaalsContact O-CB 3.28Å; A63-E67 WeakPolarHBondContact O-CB 3.16Å; A63-E67 VanDerWaalsContact O-CG 3.31Å; A63-E67 WeakPolarHBondContact O-CG 3.41Å; A63-E67 PolarHBondContact O-N 3.12Å; E67-F69 VanDerWaalsContact C-N 3.3Å; E67-F69 PolarHBondContact O-N 2.91Å; E67-C70 PolarHBondContact O-N 2.74Å; E67-V71 VanDerWaalsContact O-CG2 3.31Å; E67-V71 WeakPolarHBondContact O-CG2 3.24Å; E67-V71 PolarHBondContact O-N 3.34Å
68	T	64.1	Low	55.3	Low	79 Å²	79	90.5 Å²	90.5	49%	0.485	51%	0.513	S	S	.	.	H	α-helix	trans	-61.6	-41.2	176	-54.3	0	0	0	0	110.7	S64 V65 V71 M72	S64-T68 WeakPolarHBondContact O-CB 3.48Å; S64-T68 PolarHBondContact O-N 3.19Å; S64-T68 PolarHBondContact O-OG1 3.33Å; V65-T68 PolarHBondContact O-N 3.42Å; T68-V71 PolarHBondContact O-N 2.95Å; T68-M72 WeakPolarHBondContact O-CB 3.36Å; T68-M72 VanDerWaalsContact O-CG 3.27Å; T68-M72 WeakPolarHBondContact O-CG 3.39Å; T68-M72 PolarHBondContact O-N 3.23Å
69	F	60	Low	55.9	Low	109 Å²	109	89 Å²	89	48%	0.478	50%	0.504	S	S	.	.	H	α-helix	trans	-67.2	-38.7	175.9	-158.6	-94.4	0	0	0	112.2	V65 I66 E67 M72 A73 T194	V65-F69 WeakPolarHBondContact O-CB 3.46Å; V65-F69 PolarHBondContact O-N 3.49Å; I66-F69 PolarHBondContact O-N 2.95Å; E67-F69 VanDerWaalsContact C-N 3.3Å; E67-F69 PolarHBondContact O-N 2.91Å; F69-M72 PolarHBondContact O-N 3.39Å; F69-A73 VanDerWaalsContact O-CB 3.28Å; F69-A73 WeakPolarHBondContact O-CB 3.43Å; F69-A73 PolarHBondContact O-N 3.23Å; F69-T194 HydrophobicContact CD2-CG2 4.38Å; F69-T194 HydrophobicContact CE2-CG2 3.73Å; F69-T194 HydrophobicContact CZ-CG2 4.05Å
70	C	60.1	Low	56.2	Low	69 Å²	69	92.3 Å²	92.3	47%	0.466	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-41.4	176.9	-150.3	0	0	0	0	111	I66 E67 A73 L74	I66-C70 WeakPolarHBondContact O-CB 3.4Å; I66-C70 PolarHBondContact O-N 3.3Å; E67-C70 PolarHBondContact O-N 2.74Å; C70-A73 PolarHBondContact O-N 2.85Å; C70-L74 VanDerWaalsContact O-CB 3.22Å; C70-L74 WeakPolarHBondContact O-CB 3.43Å; C70-L74 WeakPolarHBondContact O-CD1 3.29Å; C70-L74 WeakPolarHBondContact O-CG 3.39Å; C70-L74 PolarHBondContact O-N 3.01Å
71	V	62.1	Low	56.3	Low	89 Å²	89	93 Å²	93	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-40.3	172.8	174	0	0	0	0	111.3	E67 T68 T75	E67-V71 VanDerWaalsContact O-CG2 3.31Å; E67-V71 WeakPolarHBondContact O-CG2 3.24Å; E67-V71 PolarHBondContact O-N 3.34Å; T68-V71 PolarHBondContact O-N 2.95Å; V71-T75 HydrophobicContact CG1-CG2 4.39Å; V71-T75 WeakPolarHBondContact O-CB 3.34Å; V71-T75 VanDerWaalsContact O-CG2 3.24Å; V71-T75 WeakPolarHBondContact O-CG2 3.44Å; V71-T75 PolarHBondContact O-N 3.4Å; V71-T75 PolarHBondContact O-OG1 2.92Å
72	M	59.9	Low	56.4	Low	110 Å²	110	96.6 Å²	96.6	54%	0.542	51%	0.514	S	S	.	.	H	α-helix	trans	-68.5	-38.4	175.7	-72.7	-129.9	-69.3	0	0	113	T68 F69 T75 K76	T68-M72 WeakPolarHBondContact O-CB 3.36Å; T68-M72 VanDerWaalsContact O-CG 3.27Å; T68-M72 WeakPolarHBondContact O-CG 3.39Å; T68-M72 PolarHBondContact O-N 3.23Å; F69-M72 PolarHBondContact O-N 3.39Å; M72-T75 VanDerWaalsContact CA-OG1 3.24Å; M72-T75 WeakPolarHBondContact CA-OG1 3.42Å; M72-T75 PolarHBondContact O-OG1 2.98Å; M72-K76 WeakPolarHBondContact O-CB 3.18Å; M72-K76 PolarHBondContact O-N 3.31Å
73	A	58	Low	55.9	Low	50 Å²	50	95.8 Å²	95.8	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-70.1	-41.5	176.1	0	0	0	0	0	111.7	F69 C70 K76 K77	F69-A73 VanDerWaalsContact O-CB 3.28Å; F69-A73 WeakPolarHBondContact O-CB 3.43Å; F69-A73 PolarHBondContact O-N 3.23Å; C70-A73 PolarHBondContact O-N 2.85Å; A73-K76 PolarHBondContact O-N 3.4Å; A73-K77 WeakPolarHBondContact O-CB 3.22Å; A73-K77 PolarHBondContact O-N 3.41Å
74	L	53.4	Low	55.5	Low	98 Å²	98	98 Å²	98	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-68.2	-37.1	174.7	-72.9	167	0	0	0	111.9	C70 K77 T78	C70-L74 VanDerWaalsContact O-CB 3.22Å; C70-L74 WeakPolarHBondContact O-CB 3.43Å; C70-L74 WeakPolarHBondContact O-CD1 3.29Å; C70-L74 WeakPolarHBondContact O-CG 3.39Å; C70-L74 PolarHBondContact O-N 3.01Å; L74-K77 PolarHBondContact O-N 3.48Å; L74-T78 WeakPolarHBondContact O-CB 3.27Å; L74-T78 WeakPolarHBondContact O-CG2 3.34Å; L74-T78 PolarHBondContact O-N 2.94Å; L74-T78 PolarHBondContact O-OG1 2.96Å
75	T	57.1	Low	54.8	Low	61 Å²	61	107.2 Å²	107.2	37%	0.374	56%	0.556	S	S	.	*	H	α-helix	trans	-67.9	-41.6	174.2	47.2	0	0	0	0	111.6	V71 M72 K77 T78 L79	V71-T75 HydrophobicContact CG1-CG2 4.39Å; V71-T75 WeakPolarHBondContact O-CB 3.34Å; V71-T75 VanDerWaalsContact O-CG2 3.24Å; V71-T75 WeakPolarHBondContact O-CG2 3.44Å; V71-T75 PolarHBondContact O-N 3.4Å; V71-T75 PolarHBondContact O-OG1 2.92Å; M72-T75 VanDerWaalsContact CA-OG1 3.24Å; M72-T75 WeakPolarHBondContact CA-OG1 3.42Å; M72-T75 PolarHBondContact O-OG1 2.98Å; T75-K77 VanDerWaalsContact C-N 3.32Å; T75-K77 PolarHBondContact O-N 2.99Å; T75-T78 VanDerWaalsContact CA-OG1 3.32Å; T75-T78 WeakPolarHBondContact CA-OG1 3.49Å; T75-T78 PolarHBondContact O-N 3.48Å; T75-T78 PolarHBondContact O-OG1 2.86Å; T75-L79 VanDerWaalsContact O-CB 3.26Å; T75-L79 WeakPolarHBondContact O-CB 3.42Å; T75-L79 WeakPolarHBondContact O-CD1 3.28Å; T75-L79 WeakPolarHBondContact O-CG 3.41Å; T75-L79 PolarHBondContact O-N 3.27Å
76	K	57.5	Low	53.6	Low	127 Å²	127	105.5 Å²	105.5	55%	0.552	55%	0.554	S	S	*	*	H	α-helix	trans	-64.1	-32.3	171.3	-77.7	-173.9	178	-172.4	0	113.2	M72 A73 R80	M72-K76 WeakPolarHBondContact O-CB 3.18Å; M72-K76 PolarHBondContact O-N 3.31Å; A73-K76 PolarHBondContact O-N 3.4Å; K76-R80 WeakPolarHBondContact O-CB 3.35Å; K76-R80 WeakPolarHBondContact O-CG 3.33Å; K76-R80 PolarHBondContact O-N 2.97Å; K76-R80 PolarHBondContact O-NE 3.45Å
77	K	54.1	Low	52.4	Low	135 Å²	135	105.8 Å²	105.8	59%	0.587	57%	0.565	S	S	*	*	H	α-helix	trans	-77.2	-38.9	176.7	-163.2	174.4	-175.7	179	0	112.2	A73 L74 T75 R80 L81	A73-K77 WeakPolarHBondContact O-CB 3.22Å; A73-K77 PolarHBondContact O-N 3.41Å; L74-K77 PolarHBondContact O-N 3.48Å; T75-K77 VanDerWaalsContact C-N 3.32Å; T75-K77 PolarHBondContact O-N 2.99Å; K77-R80 PolarHBondContact O-N 2.75Å; K77-L81 HydrophobicContact CG-CD1 4.21Å; K77-L81 WeakPolarHBondContact O-CB 3.3Å; K77-L81 WeakPolarHBondContact O-CG 3.4Å; K77-L81 PolarHBondContact O-N 3.42Å
78	T	50.3	Low	51.7	Low	66 Å²	66	108.9 Å²	108.9	41%	0.405	57%	0.571	S	S	.	*	H	α-helix	trans	-73.8	-36.3	175.7	49.6	0	0	0	0	112	L74 T75 R80 L81 L82	L74-T78 WeakPolarHBondContact O-CB 3.27Å; L74-T78 WeakPolarHBondContact O-CG2 3.34Å; L74-T78 PolarHBondContact O-N 2.94Å; L74-T78 PolarHBondContact O-OG1 2.96Å; T75-T78 VanDerWaalsContact CA-OG1 3.32Å; T75-T78 WeakPolarHBondContact CA-OG1 3.49Å; T75-T78 PolarHBondContact O-N 3.48Å; T75-T78 PolarHBondContact O-OG1 2.86Å; T78-R80 VanDerWaalsContact C-N 3.29Å; T78-R80 PolarHBondContact O-N 3.45Å; T78-L81 PolarHBondContact O-N 2.84Å; T78-L82 WeakPolarHBondContact O-CB 3.43Å; T78-L82 WeakPolarHBondContact O-CD1 3.31Å; T78-L82 PolarHBondContact O-N 3.18Å
79	L	53.1	Low	50.7	Low	129 Å²	129	108.7 Å²	108.7	68%	0.675	57%	0.573	S	S	*	*	H	α-helix	trans	-62.1	-36.8	168.7	-84.7	154.7	0	0	0	111.8	T75 G83	T75-L79 VanDerWaalsContact O-CB 3.26Å; T75-L79 WeakPolarHBondContact O-CB 3.42Å; T75-L79 WeakPolarHBondContact O-CD1 3.28Å; T75-L79 WeakPolarHBondContact O-CG 3.41Å; T75-L79 PolarHBondContact O-N 3.27Å; L79-G83 WeakPolarHBondContact O-CA 3.26Å; L79-G83 PolarHBondContact O-N 3.31Å
80	R	50.9	Low	50	Low	173 Å²	173	106.8 Å²	106.8	65%	0.653	58%	0.578	S	S	*	*	H	α-helix	trans	-67.5	-38.9	172	-82.9	-174.8	-102.5	-175.9	-8.5	113.1	K76 K77 T78	K76-R80 WeakPolarHBondContact O-CB 3.35Å; K76-R80 WeakPolarHBondContact O-CG 3.33Å; K76-R80 PolarHBondContact O-N 2.97Å; K76-R80 PolarHBondContact O-NE 3.45Å; K77-R80 PolarHBondContact O-N 2.75Å; T78-R80 VanDerWaalsContact C-N 3.29Å; T78-R80 PolarHBondContact O-N 3.45Å
81	L	50.5	Low	49.4	Very low	119 Å²	119	105.1 Å²	105.1	62%	0.623	57%	0.567	S	S	*	*	H	α-helix	trans	-80.4	-31.9	-179.6	-72.6	164.8	0	0	0	113.8	K77 T78	K77-L81 HydrophobicContact CG-CD1 4.21Å; K77-L81 WeakPolarHBondContact O-CB 3.3Å; K77-L81 WeakPolarHBondContact O-CG 3.4Å; K77-L81 PolarHBondContact O-N 3.42Å; T78-L81 PolarHBondContact O-N 2.84Å
82	L	51.6	Low	48.7	Very low	139 Å²	139	106.9 Å²	106.9	73%	0.728	57%	0.569	S	S	*	*	H	α-helix	trans	-79.9	-24	170.7	-81.2	109.8	0	0	0	112	T78 S84	T78-L82 WeakPolarHBondContact O-CB 3.43Å; T78-L82 WeakPolarHBondContact O-CD1 3.31Å; T78-L82 PolarHBondContact O-N 3.18Å; L82-S84 PolarHBondContact O-N 2.88Å
83	G	44.3	Very low	48.2	Very low	41 Å²	41	105.8 Å²	105.8	42%	0.423	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-68.1	-12.9	168.8	0	0	0	0	0	114.3	L79 R85 G86	L79-G83 WeakPolarHBondContact O-CA 3.26Å; L79-G83 PolarHBondContact O-N 3.31Å; G83-R85 PolarHBondContact O-N 2.81Å; G83-G86 PolarHBondContact O-N 3.41Å; G83-G86 VanDerWaalsContact O-N 3.14Å
84	S	43.3	Very low	48	Very low	97 Å²	97	105.7 Å²	105.7	68%	0.678	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-76	7	177.2	-80.3	0	0	0	0	115.2	L82	L82-S84 PolarHBondContact O-N 2.88Å
85	R	39.2	Very low	48.1	Very low	246 Å²	246	105.8 Å²	105.8	93%	0.928	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-94	3.4	162.8	-84.5	-175	160.4	168	-4.3	114.2	G83	G83-R85 PolarHBondContact O-N 2.81Å
86	G	34.4	Very low	47.9	Very low	38 Å²	38	107 Å²	107	39%	0.392	57%	0.566	S	S	.	*			trans	-105.4	102.6	167.8	0	0	0	0	0	110.8	G83 R88	G83-G86 PolarHBondContact O-N 3.41Å; G83-G86 VanDerWaalsContact O-N 3.14Å; G86-R88 PolarHBondContact O-N 2.69Å
87	S	38.4	Very low	47.8	Very low	114 Å²	114	105 Å²	105	80%	0.797	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	25.1	166.2	49.3	0	0	0	0	114	S91	S87-S91 PolarHBondContact O-OG 2.9Å
88	R	43.9	Very low	48.1	Very low	198 Å²	198	101.9 Å²	101.9	75%	0.747	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-21.4	-171.5	-72.1	-175.9	168.7	179.6	-3.5	115.1	G86 S91 Q92	G86-R88 PolarHBondContact O-N 2.69Å; R88-S91 VanDerWaalsContact C-OG 3.27Å; R88-S91 VanDerWaalsContact CA-OG 3.23Å; R88-S91 WeakPolarHBondContact CA-OG 3.26Å; R88-S91 PolarHBondContact O-OG 3.37Å; R88-Q92 WeakPolarHBondContact O-CG 3.44Å; R88-Q92 PolarHBondContact O-N 3.14Å
89	S	43.7	Very low	48.7	Very low	74 Å²	74	107 Å²	107	52%	0.517	56%	0.563	S	S	.	*	H	α-helix	trans	-89.5	-33.4	-177.2	68.4	0	0	0	0	113.9	S91 Q92 T93	S89-S91 VanDerWaalsContact C-N 3.29Å; S89-Q92 PolarHBondContact O-N 3.43Å; S89-T93 PolarHBondContact O-N 3.37Å; S89-T93 VanDerWaalsContact O-N 3.08Å; S89-T93 PolarHBondContact O-OG1 3.48Å
90	A	44.5	Very low	49	Very low	70 Å²	70	105.1 Å²	105.1	58%	0.579	55%	0.554	S	S	*	*	H	α-helix	trans	-68.3	-31.9	168.1	0	0	0	0	0	111.3	T93 S94	A90-T93 WeakPolarHBondContact CA-OG1 3.27Å; A90-T93 PolarHBondContact O-OG1 3.23Å; A90-S94 VanDerWaalsContact O-CB 3.29Å; A90-S94 WeakPolarHBondContact O-CB 3.43Å; A90-S94 PolarHBondContact O-N 2.72Å; A90-S94 PolarHBondContact O-OG 2.69Å; A90-S94 VanDerWaalsContact O-OG 3.1Å
91	S	47.7	Very low	49.1	Very low	34 Å²	34	101.4 Å²	101.4	24%	0.238	54%	0.54	C	S	.	.	H	α-helix	trans	-73.8	-38.7	172.7	60.1	0	0	0	0	111.7	S87 R88 S89 T93 S94 Q95	S87-S91 PolarHBondContact O-OG 2.9Å; R88-S91 VanDerWaalsContact C-OG 3.27Å; R88-S91 VanDerWaalsContact CA-OG 3.23Å; R88-S91 WeakPolarHBondContact CA-OG 3.26Å; R88-S91 PolarHBondContact O-OG 3.37Å; S89-S91 VanDerWaalsContact C-N 3.29Å; S91-T93 PolarHBondContact O-N 3.22Å; S91-S94 PolarHBondContact O-N 3.02Å; S91-S94 PolarHBondContact O-OG 3.42Å; S91-Q95 WeakPolarHBondContact O-CA 3.33Å; S91-Q95 WeakPolarHBondContact O-CB 3.47Å; S91-Q95 WeakPolarHBondContact O-CG 3.49Å; S91-Q95 PolarHBondContact O-N 3.12Å
92	Q	47.7	Very low	48.9	Very low	125 Å²	125	98 Å²	98	58%	0.584	53%	0.534	S	S	*	.	H	α-helix	trans	-64.1	-40.7	173.8	-82.3	179.9	-2.6	0	0	113.6	R88 S89 L96	R88-Q92 WeakPolarHBondContact O-CG 3.44Å; R88-Q92 PolarHBondContact O-N 3.14Å; S89-Q92 PolarHBondContact O-N 3.43Å; Q92-L96 VanDerWaalsContact O-CB 3.25Å; Q92-L96 WeakPolarHBondContact O-CB 3.44Å; Q92-L96 VanDerWaalsContact O-CG 3.25Å; Q92-L96 WeakPolarHBondContact O-CG 3.27Å; Q92-L96 PolarHBondContact O-N 3.15Å
93	T	49.7	Very low	49	Very low	87 Å²	87	99 Å²	99	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-69.4	-40.8	176.5	46.8	0	0	0	0	111.8	S89 A90 S91 E97	S89-T93 PolarHBondContact O-N 3.37Å; S89-T93 VanDerWaalsContact O-N 3.08Å; S89-T93 PolarHBondContact O-OG1 3.48Å; A90-T93 WeakPolarHBondContact CA-OG1 3.27Å; A90-T93 PolarHBondContact O-OG1 3.23Å; S91-T93 PolarHBondContact O-N 3.22Å; T93-E97 WeakPolarHBondContact O-CB 3.46Å; T93-E97 WeakPolarHBondContact O-CG 3.33Å; T93-E97 PolarHBondContact O-N 3.3Å
94	S	53.5	Low	49.1	Very low	49 Å²	49	103.5 Å²	103.5	34%	0.343	55%	0.547	S	S	.	.	H	α-helix	trans	-71.4	-33.1	173.7	76.3	0	0	0	0	113.6	A90 S91 E97 E98	A90-S94 VanDerWaalsContact O-CB 3.29Å; A90-S94 WeakPolarHBondContact O-CB 3.43Å; A90-S94 PolarHBondContact O-N 2.72Å; A90-S94 PolarHBondContact O-OG 2.69Å; A90-S94 VanDerWaalsContact O-OG 3.1Å; S91-S94 PolarHBondContact O-N 3.02Å; S91-S94 PolarHBondContact O-OG 3.42Å; S94-E97 PolarHBondContact O-N 2.9Å; S94-E98 WeakPolarHBondContact O-CB 3.35Å; S94-E98 PolarHBondContact O-N 3.16Å
95	Q	54.2	Low	49.5	Very low	99 Å²	99	104.4 Å²	104.4	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-74.7	-32.2	176.4	-74.7	171.5	13.6	0	0	111.5	S91 K99	S91-Q95 WeakPolarHBondContact O-CA 3.33Å; S91-Q95 WeakPolarHBondContact O-CB 3.47Å; S91-Q95 WeakPolarHBondContact O-CG 3.49Å; S91-Q95 PolarHBondContact O-N 3.12Å; Q95-K99 VanDerWaalsContact O-CB 3.25Å; Q95-K99 WeakPolarHBondContact O-CB 3.32Å; Q95-K99 VanDerWaalsContact O-CG 3.28Å; Q95-K99 WeakPolarHBondContact O-CG 3.24Å; Q95-K99 PolarHBondContact O-N 3.29Å
96	L	54.2	Low	49.9	Very low	86 Å²	86	101.7 Å²	101.7	45%	0.45	53%	0.53	S	S	.	.	H	α-helix	trans	-68.9	-42.3	168.1	-78.3	170.4	0	0	0	110.7	Q92 E98 K99 L100	Q92-L96 VanDerWaalsContact O-CB 3.25Å; Q92-L96 WeakPolarHBondContact O-CB 3.44Å; Q92-L96 VanDerWaalsContact O-CG 3.25Å; Q92-L96 WeakPolarHBondContact O-CG 3.27Å; Q92-L96 PolarHBondContact O-N 3.15Å; L96-E98 VanDerWaalsContact C-N 3.33Å; L96-E98 PolarHBondContact O-N 2.72Å; L96-K99 PolarHBondContact O-N 3.08Å; L96-L100 VanDerWaalsContact O-CB 3.26Å; L96-L100 WeakPolarHBondContact O-CB 3.46Å; L96-L100 WeakPolarHBondContact O-CG 3.33Å; L96-L100 PolarHBondContact O-N 3.45Å
97	E	55.2	Low	50.5	Low	85 Å²	85	110.8 Å²	110.8	40%	0.397	55%	0.552	S	S	.	*	H	α-helix	trans	-62	-39.1	173	-78	-173.1	163.1	0	0	111.7	T93 S94 Y101 R151	T93-E97 WeakPolarHBondContact O-CB 3.46Å; T93-E97 WeakPolarHBondContact O-CG 3.33Å; T93-E97 PolarHBondContact O-N 3.3Å; S94-E97 PolarHBondContact O-N 2.9Å; E97-Y101 PolarHBondContact O-N 2.95Å; E97-R151 IonicContact OE1-NH2 3.22Å; E97-R151 PolarHBondContact OE1-NH2 3.49Å; E97-R151 IonicContact OE2-NH2 3.09Å
98	E	60.2	Low	50.8	Low	70 Å²	70	116.3 Å²	116.3	33%	0.327	56%	0.556	S	S	.	*	H	α-helix	trans	-77.8	-27.5	-178.8	-154.6	170.9	-147.7	0	0	113.4	S94 L96 K103 R106	S94-E98 WeakPolarHBondContact O-CB 3.35Å; S94-E98 PolarHBondContact O-N 3.16Å; L96-E98 VanDerWaalsContact C-N 3.33Å; L96-E98 PolarHBondContact O-N 2.72Å; E98-K103 HydrophobicContact CG-CG 4.49Å; E98-R106 IonicContact OE1-CZ 3.29Å; E98-R106 IonicContact OE1-NH2 3.77Å; E98-R106 PolarHBondContact OE1-NH2 3.09Å; E98-R106 VanDerWaalsContact OE1-NH2 3.15Å
99	K	63	Low	50.9	Low	174 Å²	174	114.2 Å²	114.2	76%	0.757	56%	0.559	S	S	*	*	H	α-helix	trans	-79.4	-28.7	172.3	-80.3	179.4	177.6	-179.7	0	113.3	Q95 L96	Q95-K99 VanDerWaalsContact O-CB 3.25Å; Q95-K99 WeakPolarHBondContact O-CB 3.32Å; Q95-K99 VanDerWaalsContact O-CG 3.28Å; Q95-K99 WeakPolarHBondContact O-CG 3.24Å; Q95-K99 PolarHBondContact O-N 3.29Å; L96-K99 PolarHBondContact O-N 3.08Å
100	L	58	Low	51.1	Low	90 Å²	90	115.5 Å²	115.5	47%	0.471	57%	0.568	S	S	.	*	H	α-helix	trans	-91.4	-28.2	-176.8	-69.4	177	0	0	0	113.2	L96 Q217	L96-L100 VanDerWaalsContact O-CB 3.26Å; L96-L100 WeakPolarHBondContact O-CB 3.46Å; L96-L100 WeakPolarHBondContact O-CG 3.33Å; L96-L100 PolarHBondContact O-N 3.45Å; L100-Q217 HydrophobicContact CD1-CG 4.44Å; L100-Q217 HydrophobicContact CD2-CG 4.49Å
101	Y	53.1	Low	51.2	Low	94 Å²	94	123.7 Å²	123.7	37%	0.369	58%	0.584	S	S	.	*	S	Bend	trans	-130	102.9	179.3	-59.5	-89.2	0	0	0	106.9	E97 Q217	E97-Y101 PolarHBondContact O-N 2.95Å; Y101-Q217 PolarHBondContact OH-OE1 3.35Å
102	G	47.6	Very low	51	Low	47 Å²	47	127.3 Å²	127.3	49%	0.485	61%	0.607	S	S	.	*			trans	-45.9	158.9	-176.1	0	0	0	0	0	113.8	D104	G102-D104 PolarHBondContact O-N 3.22Å
103	K	53	Low	50.8	Low	161 Å²	161	125.6 Å²	125.6	70%	0.7	61%	0.608	S	S	*	*	S	Bend	trans	-54.3	10.2	-173.8	-109.5	172.3	178.9	172	0	117	E98 H105	E98-K103 HydrophobicContact CG-CG 4.49Å; K103-H105 VanDerWaalsContact C-N 3.32Å; K103-H105 PolarHBondContact O-N 3.33Å
104	D	47	Very low	50.4	Low	136 Å²	136	131.6 Å²	131.6	73%	0.727	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	7.3	-168.8	-63.9	-37.5	0	0	0	114.9	G102	G102-D104 PolarHBondContact O-N 3.22Å
105	H	50.9	Low	50	Low	115 Å²	115	136.9 Å²	136.9	53%	0.532	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.1	1.2	-178.5	-63.5	-7.4	0	0	0	114.7	K103 R141	K103-H105 VanDerWaalsContact C-N 3.32Å; K103-H105 PolarHBondContact O-N 3.33Å; H105-R141 PolarHBondContact CE1-NH1 3.41Å; H105-R141 PolarHBondContact NE2-NH1 2.95Å
106	R	47.2	Very low	49.3	Very low	190 Å²	190	137.7 Å²	137.7	72%	0.717	66%	0.663	S	S	*	*	S	Bend	trans	-95.2	2.1	175.7	-61.7	-164.8	-162.9	172.7	13	115.2	E98	E98-R106 IonicContact OE1-CZ 3.29Å; E98-R106 IonicContact OE1-NH2 3.77Å; E98-R106 PolarHBondContact OE1-NH2 3.09Å; E98-R106 VanDerWaalsContact OE1-NH2 3.15Å
107	R	47.1	Very low	49	Very low	229 Å²	229	138.4 Å²	138.4	86%	0.864	68%	0.675	S	S	*	*	S	Bend	trans	-99.9	7.5	-174.7	-75.5	-168.7	174.4	-174.5	-0.5	116.6
108	R	45	Very low	48.5	Very low	230 Å²	230	139.5 Å²	139.5	87%	0.868	69%	0.692	S	S	*	*	S	Bend	trans	-121.4	0.6	-175	-138.5	177	-156.6	-171.3	6.6	118.1
109	D	47.3	Very low	47.7	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	72%	0.718	S	S	*	*			trans	-105	7.1	179.4	-67.6	-30.8	0	0	0	114.1	R111	D109-R111 VanDerWaalsContact C-N 3.26Å; D109-R111 PolarHBondContact O-N 2.98Å; D109-R111 VanDerWaalsContact O-N 3.11Å
110	S	46.8	Very low	46.9	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	72%	0.716	S	S	*	*			trans	-84.2	67.2	165.1	43.7	0	0	0	0	111.3
111	R	47.8	Very low	46.4	Very low	242 Å²	242	144.3 Å²	144.3	91%	0.913	73%	0.732	S	S	*	*			trans	-130.4	97.6	155.6	-113.9	-172.9	-178.5	-174.1	2.1	108.9	D109	D109-R111 VanDerWaalsContact C-N 3.26Å; D109-R111 PolarHBondContact O-N 2.98Å; D109-R111 VanDerWaalsContact O-N 3.11Å
112	P	41.9	Very low	45.9	Very low	110 Å²	110	149.2 Å²	149.2	71%	0.714	76%	0.755	S	S	*	*			trans	-120.2	141.4	150	21.9	-3.3	0	0	0	111.6
113	S	44.3	Very low	45.6	Very low	88 Å²	88	151.4 Å²	151.4	62%	0.615	77%	0.768	S	S	*	*			trans	54.6	98.2	165.9	70.6	0	0	0	0	118.9	H115	S113-H115 PolarHBondContact O-N 3.06Å; S113-H115 VanDerWaalsContact O-N 3.14Å
114	K	41.5	Very low	45	Very low	214 Å²	214	155.5 Å²	155.5	93%	0.93	78%	0.779	S	S	*	*			trans	-55.4	112.4	139.6	-101.8	-179.5	172.6	-177.6	0	106.8	S116	K114-S116 PolarHBondContact O-N 3.07Å
115	H	44.2	Very low	45.1	Very low	160 Å²	160	154.2 Å²	154.2	74%	0.741	78%	0.781	S	S	*	*			trans	-63.5	125	165.5	-79.7	-38.3	0	0	0	109.2	S113 S117	S113-H115 PolarHBondContact O-N 3.06Å; S113-H115 VanDerWaalsContact O-N 3.14Å; H115-S117 PolarHBondContact O-N 2.89Å
116	S	41.1	Very low	45	Very low	116 Å²	116	156 Å²	156	81%	0.811	80%	0.795	S	S	*	*			trans	-57.5	110.9	156.7	49.2	0	0	0	0	109.3	K114	K114-S116 PolarHBondContact O-N 3.07Å
117	S	46.5	Very low	44.8	Very low	100 Å²	100	157 Å²	157	70%	0.699	80%	0.804	S	S	*	*			trans	-148.9	97.6	151.4	50.2	0	0	0	0	108.3	H115	H115-S117 PolarHBondContact O-N 2.89Å
118	S	44.3	Very low	45.1	Very low	109 Å²	109	149 Å²	149	76%	0.762	79%	0.793	S	S	*	*			trans	21.2	106.2	142.7	57.8	0	0	0	0	116.9
119	K	44.4	Very low	45.3	Very low	201 Å²	201	145.9 Å²	145.9	87%	0.874	79%	0.793	S	S	*	*				-174.1	142.8	125.7	-104.5	161.6	-179.3	175.6	0	111.5
120	S	46	Very low	45.5	Very low	102 Å²	102	147.9 Å²	147.9	71%	0.713	80%	0.795	S	S	*	*			trans	69.2	98.3	156	58.3	0	0	0	0	120.1
121	V	46.8	Very low	46	Very low	132 Å²	132	148.5 Å²	148.5	80%	0.8	79%	0.794	S	S	*	*				70.6	112	110.3	176.7	0	0	0	0	116.5
122	K	42.3	Very low	46.5	Very low	196 Å²	196	143.5 Å²	143.5	85%	0.852	79%	0.79	S	S	*	*				123.7	135.6	125.5	-142.3	144.4	180	172	0	116.3
123	A	42.3	Very low	47.3	Very low	93 Å²	93	143.4 Å²	143.4	77%	0.769	79%	0.788	S	S	*	*			trans	78.8	96	154.3	0	0	0	0	0	118.4
124	R	39.5	Very low	48.1	Very low	248 Å²	248	147.9 Å²	147.9	94%	0.936	80%	0.799	S	S	*	*			trans	-51.1	132.6	144	-62.2	168.2	165.2	-179.8	-6.2	109.6
125	S	50.8	Low	49.1	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	79%	0.794	S	S	*	*			trans	-171.8	130.4	137	-160	0	0	0	0	112
126	D	48.1	Very low	50	Low	152 Å²	152	146.4 Å²	146.4	81%	0.813	80%	0.798	S	S	*	*			trans	62.7	121.6	152.1	-93.6	-34	0	0	0	124.8	G128	D126-G128 PolarHBondContact O-N 3.5Å; D126-G128 VanDerWaalsContact O-N 3.12Å
127	K	43.4	Very low	51.7	Low	212 Å²	212	152.6 Å²	152.6	92%	0.922	80%	0.803	S	S	*	*			trans	-69.3	90.6	159.9	-81.1	172.3	171	173.5	0	108.9
128	G	53.2	Low	53.3	Low	60 Å²	60	158.8 Å²	158.8	62%	0.619	81%	0.811	S	S	*	*			trans	-82.5	125.4	166.5	0	0	0	0	0	112.1	D126 K130	D126-G128 PolarHBondContact O-N 3.5Å; D126-G128 VanDerWaalsContact O-N 3.12Å; G128-K130 PolarHBondContact O-N 3.34Å; G128-K130 VanDerWaalsContact O-N 3.15Å
129	N	49.8	Very low	55.2	Low	164 Å²	164	165.1 Å²	165.1	88%	0.877	82%	0.819	S	S	*	*			trans	-42.7	110	174.5	-129.3	-3.7	0	0	0	112	T131	N129-T131 PolarHBondContact O-N 2.81Å; N129-T131 VanDerWaalsContact O-N 3.14Å
130	K	51.5	Low	57.1	Low	197 Å²	197	163.7 Å²	163.7	86%	0.857	81%	0.808	S	S	*	*			trans	-83.1	91.7	174	-77.2	179.6	-178.6	171.4	0	108.8	G128 V132	G128-K130 PolarHBondContact O-N 3.34Å; G128-K130 VanDerWaalsContact O-N 3.15Å; K130-V132 PolarHBondContact O-N 2.92Å
131	T	56.6	Low	59.1	Low	113 Å²	113	166.5 Å²	166.5	69%	0.693	80%	0.803	S	S	*	*			trans	-47.4	131.7	158.9	49.2	0	0	0	0	108.5	N129 T133	N129-T131 PolarHBondContact O-N 2.81Å; N129-T131 VanDerWaalsContact O-N 3.14Å; T131-T133 PolarHBondContact O-N 3.3Å
132	V	58.7	Low	61	Low	138 Å²	138	166.1 Å²	166.1	84%	0.836	80%	0.803	S	S	*	*			trans	-66.2	84.2	177.1	-178.1	0	0	0	0	106.8	K130 E134	K130-V132 PolarHBondContact O-N 2.92Å; V132-E134 PolarHBondContact O-N 3.43Å
133	T	58.7	Low	63.3	Low	108 Å²	108	158.1 Å²	158.1	66%	0.663	78%	0.776	S	S	*	*			trans	-58.9	110.1	163.7	38.3	0	0	0	0	105.2	T131 K135	T131-T133 PolarHBondContact O-N 3.3Å; T133-K135 PolarHBondContact O-N 2.92Å
134	E	61.2	Low	65.7	Low	181 Å²	181	157 Å²	157	85%	0.846	76%	0.759	S	S	*	*			trans	-53.9	94.2	167.3	-74.5	-170.4	158.5	0	0	106.5	V132 N136	V132-E134 PolarHBondContact O-N 3.43Å; E134-N136 PolarHBondContact O-N 3.5Å
135	K	61.1	Low	68.1	Low	189 Å²	189	149.1 Å²	149.1	82%	0.822	74%	0.735	S	S	*	*			trans	-57.4	108.4	179.7	-86.5	179.2	177.2	170.9	0	105.8	T133 R137	T133-K135 PolarHBondContact O-N 2.92Å; K135-R137 PolarHBondContact O-N 3.14Å
136	N	64.3	Low	70.1	Confident	155 Å²	155	146.1 Å²	146.1	83%	0.829	72%	0.717	S	S	*	*			trans	-32.8	103.2	173	-88.7	-30.8	0	0	0	109.6	E134 R138	E134-N136 PolarHBondContact O-N 3.5Å; N136-R138 VanDerWaalsContact C-N 3.31Å; N136-R138 PolarHBondContact O-N 3.46Å
137	R	75.7	Confident	72.2	Confident	246 Å²	246	141.7 Å²	141.7	93%	0.928	69%	0.693	S	S	*	*			trans	-68.5	95.4	-172.7	-167.3	177.6	84.2	-178	3.9	107	K135 R139	K135-R137 PolarHBondContact O-N 3.14Å; R137-R139 PolarHBondContact O-N 3.22Å
138	R	81	Confident	74.6	Confident	230 Å²	230	140.6 Å²	140.6	87%	0.868	68%	0.683	S	S	*	*			trans	-51.3	115.4	-174.4	-67.7	-177.9	179.8	176.9	-0.3	109.6	N136 R140	N136-R138 VanDerWaalsContact C-N 3.31Å; N136-R138 PolarHBondContact O-N 3.46Å; R138-R140 PolarHBondContact O-N 3.39Å
139	R	83.6	Confident	76.5	Confident	242 Å²	242	142.5 Å²	142.5	91%	0.913	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.5	128.8	173.8	-174.8	174.1	175.5	-177.8	-0.5	108.3	R137	R137-R139 PolarHBondContact O-N 3.22Å
140	R	85.3	Confident	78.6	Confident	170 Å²	170	138.7 Å²	138.7	64%	0.642	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-68.1	144.5	173.3	-62.7	-65.1	-175.2	168.4	-0.3	108.7	R138 L145	R138-R140 PolarHBondContact O-N 3.39Å; R140-L145 HydrophobicContact CB-CD2 4.44Å; R140-L145 HydrophobicContact CB-CG 4.2Å; R140-L145 HydrophobicContact CG-CD2 4.14Å; R140-L145 HydrophobicContact CG-CG 4.42Å
141	R	88.1	Confident	80.6	Confident	161 Å²	161	135.7 Å²	135.7	61%	0.608	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-60.2	146.3	172.8	-69.6	179.9	172.2	171.3	-4.4	109.8	H105 V144	H105-R141 PolarHBondContact CE1-NH1 3.41Å; H105-R141 PolarHBondContact NE2-NH1 2.95Å; R141-V144 HydrophobicContact CB-CG2 3.88Å; R141-V144 WeakPolarHBondContact O-CB 3.47Å; R141-V144 PolarHBondContact O-N 3Å
142	P	86.7	Confident	82.4	Confident	125 Å²	125	135.3 Å²	135.3	81%	0.812	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	146.3	173	26.2	-34.2	0	0	0	110	V144	P142-V144 VanDerWaalsContact C-N 3.28Å; P142-V144 PolarHBondContact O-N 2.93Å
143	G	89.4	Confident	84	Confident	27 Å²	27	133.2 Å²	133.2	28%	0.278	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	84.9	-29.9	-175.5	0	0	0	0	0	115.3	L145 A146 L147	G143-L145 PolarHBondContact O-N 2.98Å; G143-A146 PolarHBondContact O-N 3.41Å; G143-L147 WeakPolarHBondContact O-CG 3.26Å; G143-L147 PolarHBondContact O-N 3.32Å
144	V	92.5	Very high	85.7	Confident	69 Å²	69	134.6 Å²	134.6	42%	0.418	61%	0.61	S	S	.	*	H	α-helix	trans	-64.1	-41.3	-178	177	0	0	0	0	112.3	R141 P142 R148	R141-V144 HydrophobicContact CB-CG2 3.88Å; R141-V144 WeakPolarHBondContact O-CB 3.47Å; R141-V144 PolarHBondContact O-N 3Å; P142-V144 VanDerWaalsContact C-N 3.28Å; P142-V144 PolarHBondContact O-N 2.93Å; V144-R148 PolarHBondContact O-N 3.49Å
145	L	91.3	Very high	87.2	Confident	84 Å²	84	134.7 Å²	134.7	44%	0.44	61%	0.607	S	S	.	*	H	α-helix	trans	-69.9	-43.1	176.5	-66.2	179	0	0	0	111.3	R140 G143 L147 R148 E149	R140-L145 HydrophobicContact CB-CD2 4.44Å; R140-L145 HydrophobicContact CB-CG 4.2Å; R140-L145 HydrophobicContact CG-CD2 4.14Å; R140-L145 HydrophobicContact CG-CG 4.42Å; G143-L145 PolarHBondContact O-N 2.98Å; L145-L147 PolarHBondContact O-N 2.98Å; L145-R148 WeakPolarHBondContact O-CB 3.33Å; L145-R148 PolarHBondContact O-N 3.43Å; L145-R148 VanDerWaalsContact O-N 3.08Å; L145-E149 WeakPolarHBondContact O-CG 3.43Å; L145-E149 PolarHBondContact O-N 2.78Å
146	A	92	Very high	88.6	Confident	46 Å²	46	127.3 Å²	127.3	38%	0.38	59%	0.586	S	S	.	*	H	α-helix	trans	-59.2	-45.4	177.9	0	0	0	0	0	112.2	G143 R148 E149 I150	G143-A146 PolarHBondContact O-N 3.41Å; A146-R148 VanDerWaalsContact C-N 3.3Å; A146-R148 PolarHBondContact O-N 2.93Å; A146-E149 PolarHBondContact O-N 3.37Å; A146-I150 WeakPolarHBondContact O-CD1 3.2Å; A146-I150 WeakPolarHBondContact O-CG1 3.34Å; A146-I150 PolarHBondContact O-N 3.17Å
147	L	92.6	Very high	89.9	Confident	59 Å²	59	126.7 Å²	126.7	31%	0.309	59%	0.587	S	S	.	*	H	α-helix	trans	-64.2	-34.6	175.8	-70.3	174	0	0	0	112.6	G143 L145 R151	G143-L147 WeakPolarHBondContact O-CG 3.26Å; G143-L147 PolarHBondContact O-N 3.32Å; L145-L147 PolarHBondContact O-N 2.98Å; L147-R151 WeakPolarHBondContact O-CB 3.24Å; L147-R151 WeakPolarHBondContact O-CD 3.38Å; L147-R151 WeakPolarHBondContact O-CG 3.44Å; L147-R151 PolarHBondContact O-N 2.81Å; L147-R151 VanDerWaalsContact O-N 3.11Å
148	R	93.7	Very high	90.7	Very high	189 Å²	189	121.1 Å²	121.1	71%	0.713	57%	0.572	S	S	*	*	H	α-helix	trans	-66.1	-44.2	174.9	-174.8	-177.2	-178.5	-165.5	-0	111.1	V144 L145 A146 R151 L152	V144-R148 PolarHBondContact O-N 3.49Å; L145-R148 WeakPolarHBondContact O-CB 3.33Å; L145-R148 PolarHBondContact O-N 3.43Å; L145-R148 VanDerWaalsContact O-N 3.08Å; A146-R148 VanDerWaalsContact C-N 3.3Å; A146-R148 PolarHBondContact O-N 2.93Å; R148-R151 PolarHBondContact O-N 2.83Å; R148-L152 WeakPolarHBondContact O-CB 3.28Å; R148-L152 PolarHBondContact O-N 3.15Å
149	E	93.5	Very high	91.3	Very high	100 Å²	100	113 Å²	113	47%	0.467	55%	0.545	S	S	.	.	H	α-helix	trans	-64.4	-46.3	177.6	-73.5	164.9	-158.9	0	0	111.5	L145 A146 R151 L152 F153	L145-E149 WeakPolarHBondContact O-CG 3.43Å; L145-E149 PolarHBondContact O-N 2.78Å; A146-E149 PolarHBondContact O-N 3.37Å; E149-R151 VanDerWaalsContact C-N 3.31Å; E149-R151 PolarHBondContact O-N 2.73Å; E149-L152 WeakPolarHBondContact O-CB 3.44Å; E149-L152 PolarHBondContact O-N 3.28Å; E149-F153 HydrophobicContact CB-CD2 4.25Å; E149-F153 HydrophobicContact CB-CE2 3.96Å; E149-F153 HydrophobicContact CG-CE2 4.46Å; E149-F153 WeakPolarHBondContact O-CD2 3.29Å; E149-F153 PolarHBondContact O-N 3.29Å
150	I	92.4	Very high	91.8	Very high	83 Å²	83	106 Å²	106	43%	0.426	53%	0.526	S	S	.	.	H	α-helix	trans	-55.7	-47.7	175.3	-68.5	163.5	0	0	0	110.5	A146 L152 F153 Q154	A146-I150 WeakPolarHBondContact O-CD1 3.2Å; A146-I150 WeakPolarHBondContact O-CG1 3.34Å; A146-I150 PolarHBondContact O-N 3.17Å; I150-L152 VanDerWaalsContact C-N 3.28Å; I150-L152 PolarHBondContact O-N 3.29Å; I150-F153 PolarHBondContact O-N 3.38Å; I150-Q154 HydrophobicContact CG2-CG 4.33Å; I150-Q154 VanDerWaalsContact O-CB 3.28Å; I150-Q154 WeakPolarHBondContact O-CB 3.37Å; I150-Q154 WeakPolarHBondContact O-CG 3.14Å; I150-Q154 PolarHBondContact O-N 2.71Å
151	R	94.2	Very high	92.3	Very high	134 Å²	134	100.9 Å²	100.9	51%	0.506	51%	0.51	S	S	.	.	H	α-helix	trans	-66.3	-28.8	178.3	-70.2	170.1	-173.8	179.9	2.1	113	E97 L147 R148 E149 K155	E97-R151 IonicContact OE1-NH2 3.22Å; E97-R151 PolarHBondContact OE1-NH2 3.49Å; E97-R151 IonicContact OE2-NH2 3.09Å; L147-R151 WeakPolarHBondContact O-CB 3.24Å; L147-R151 WeakPolarHBondContact O-CD 3.38Å; L147-R151 WeakPolarHBondContact O-CG 3.44Å; L147-R151 PolarHBondContact O-N 2.81Å; L147-R151 VanDerWaalsContact O-N 3.11Å; R148-R151 PolarHBondContact O-N 2.83Å; E149-R151 VanDerWaalsContact C-N 3.31Å; E149-R151 PolarHBondContact O-N 2.73Å; R151-K155 WeakPolarHBondContact O-CD 3.48Å; R151-K155 VanDerWaalsContact O-CG 3.27Å; R151-K155 WeakPolarHBondContact O-CG 3.2Å
152	L	93.8	Very high	92.6	Very high	106 Å²	106	103.1 Å²	103.1	56%	0.555	52%	0.519	S	S	*	.	H	α-helix	trans	-72.3	-54.6	176.1	178.6	64.9	0	0	0	110.3	R148 E149 I150 Q154 K155 G156	R148-L152 WeakPolarHBondContact O-CB 3.28Å; R148-L152 PolarHBondContact O-N 3.15Å; E149-L152 WeakPolarHBondContact O-CB 3.44Å; E149-L152 PolarHBondContact O-N 3.28Å; I150-L152 VanDerWaalsContact C-N 3.28Å; I150-L152 PolarHBondContact O-N 3.29Å; L152-Q154 VanDerWaalsContact C-N 3.33Å; L152-Q154 PolarHBondContact O-N 3.42Å; L152-K155 PolarHBondContact O-N 2.97Å; L152-K155 VanDerWaalsContact O-N 3.14Å; L152-G156 PolarHBondContact O-N 3.12Å
153	F	93.3	Very high	92.9	Very high	93 Å²	93	103.2 Å²	103.2	41%	0.408	50%	0.503	S	S	.	.	H	α-helix	trans	-68.2	-29.4	-176.6	-63.1	-51.8	0	0	0	113.2	E149 I150 K155 L160	E149-F153 HydrophobicContact CB-CD2 4.25Å; E149-F153 HydrophobicContact CB-CE2 3.96Å; E149-F153 HydrophobicContact CG-CE2 4.46Å; E149-F153 WeakPolarHBondContact O-CD2 3.29Å; E149-F153 PolarHBondContact O-N 3.29Å; I150-F153 PolarHBondContact O-N 3.38Å; F153-K155 VanDerWaalsContact C-N 3.31Å; F153-K155 PolarHBondContact O-N 3.5Å; F153-L160 HydrophobicContact CD1-CD2 3.6Å; F153-L160 HydrophobicContact CE1-CD2 3.74Å; F153-L160 HydrophobicContact CG-CD2 4.38Å
154	Q	93	Very high	93.2	Very high	138 Å²	138	110.6 Å²	110.6	65%	0.645	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-21.4	174	-74.4	179	-9.3	0	0	114.2	I150 L152	I150-Q154 HydrophobicContact CG2-CG 4.33Å; I150-Q154 VanDerWaalsContact O-CB 3.28Å; I150-Q154 WeakPolarHBondContact O-CB 3.37Å; I150-Q154 WeakPolarHBondContact O-CG 3.14Å; I150-Q154 PolarHBondContact O-N 2.71Å; L152-Q154 VanDerWaalsContact C-N 3.33Å; L152-Q154 PolarHBondContact O-N 3.42Å
155	K	93.5	Very high	93.4	Very high	182 Å²	182	110.4 Å²	110.4	79%	0.791	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-31.9	175.4	-73.4	176.9	-177.1	-173.9	0	111.9	R151 L152 F153	R151-K155 WeakPolarHBondContact O-CD 3.48Å; R151-K155 VanDerWaalsContact O-CG 3.27Å; R151-K155 WeakPolarHBondContact O-CG 3.2Å; L152-K155 PolarHBondContact O-N 2.97Å; L152-K155 VanDerWaalsContact O-N 3.14Å; F153-K155 VanDerWaalsContact C-N 3.31Å; F153-K155 PolarHBondContact O-N 3.5Å
156	G	90	Very high	93.6	Very high	35 Å²	35	107.9 Å²	107.9	36%	0.361	51%	0.508	S	S	.	.			trans	-82.1	171.7	177.6	0	0	0	0	0	113.2	L152	L152-G156 PolarHBondContact O-N 3.12Å
157	T	91.5	Very high	93.7	Very high	141 Å²	141	109.3 Å²	109.3	87%	0.865	51%	0.507	S	S	*	.			trans	-136	24.1	171.1	61.8	0	0	0	0	110.7
158	E	93.1	Very high	93.8	Very high	129 Å²	129	114.2 Å²	114.2	60%	0.603	52%	0.521	S	S	*	.			trans	-74.8	148	178.3	64.3	-173.5	169.1	0	0	110.7	L160	E158-L160 HydrophobicContact CG-CD2 4.32Å
159	L	93.4	Very high	93.9	Very high	59 Å²	59	109.1 Å²	109.1	31%	0.309	51%	0.511	S	S	.	.			trans	-72.7	127.4	174.7	-64.6	173.5	0	0	0	109.4	Q193 E197	L159-Q193 HydrophobicContact CD1-CG 4.26Å; L159-Q193 HydrophobicContact CD2-CG 4.47Å; L159-E197 VanDerWaalsContact CA-OE2 3.29Å; L159-E197 WeakPolarHBondContact CA-OE2 3.38Å
160	L	94.4	Very high	94	Very high	97 Å²	97	105.4 Å²	105.4	51%	0.508	50%	0.495	S	S	.	.			trans	-87.2	-26.6	-174.5	-58.2	-178.2	0	0	0	112.3	F153 E158 E197	F153-L160 HydrophobicContact CD1-CD2 3.6Å; F153-L160 HydrophobicContact CE1-CD2 3.74Å; F153-L160 HydrophobicContact CG-CD2 4.38Å; E158-L160 HydrophobicContact CG-CD2 4.32Å; L160-E197 PolarHBondContact N-OE1 3.17Å; L160-E197 PolarHBondContact N-OE2 3.48Å
161	I	94.9	Very high	94	Very high	61 Å²	61	106 Å²	106	31%	0.313	49%	0.492	S	S	.	.	S	Bend	trans	-82.5	132.8	178.6	-56.7	177.1	0	0	0	109.1	R163 F166 Q193 E197 L200	I161-R163 PolarHBondContact O-N 3.13Å; I161-F166 HydrophobicContact CG2-CB 3.99Å; I161-F166 HydrophobicContact CG2-CD2 4.34Å; I161-Q193 PolarHBondContact O-NE2 3.29Å; I161-E197 VanDerWaalsContact CB-OE1 3.3Å; I161-E197 WeakPolarHBondContact CB-OE1 3.45Å; I161-E197 HydrophobicContact CD1-CG 3.73Å; I161-E197 HydrophobicContact CG1-CG 3.95Å; I161-E197 PolarHBondContact N-OE1 3.42Å; I161-L200 HydrophobicContact CD1-CD1 4.32Å
162	R	95.9	Very high	94	Very high	208 Å²	208	102.5 Å²	102.5	79%	0.785	48%	0.483	S	S	*	.			trans	-62.7	132	174.9	-66.8	-178.3	-178.5	-176.7	0.4	110	R164 P165 F166	R162-R164 PolarHBondContact O-N 3.32Å; R162-P165 HydrophobicContact CB-CG 3.62Å; R162-P165 WeakPolarHBondContact O-CD 3.35Å; R162-P165 VanDerWaalsContact O-CG 3.24Å; R162-P165 WeakPolarHBondContact O-CG 3.45Å; R162-F166 PolarHBondContact O-N 3.46Å
163	R	92.9	Very high	94	Very high	128 Å²	128	100.5 Å²	100.5	48%	0.483	48%	0.475	S	S	.	.	H	α-helix	trans	-57.9	-44.1	-176.1	-65.2	179.1	172.5	-144.9	-8.4	114.1	I161 F166 Q167 E190	I161-R163 PolarHBondContact O-N 3.13Å; R163-F166 PolarHBondContact O-N 2.79Å; R163-Q167 WeakPolarHBondContact O-CB 3.18Å; R163-Q167 PolarHBondContact O-N 2.9Å; R163-E190 IonicContact CZ-OE1 3.56Å; R163-E190 VanDerWaalsContact CZ-OE1 3.22Å; R163-E190 IonicContact NH1-OE1 2.68Å; R163-E190 PolarHBondContact NH1-OE1 3.31Å; R163-E190 IonicContact NH2-OE1 3.08Å; R163-E190 PolarHBondContact NH2-OE1 2.94Å; R163-E190 VanDerWaalsContact NH2-OE1 3.09Å
164	R	94.7	Very high	94	Very high	182 Å²	182	96.7 Å²	96.7	69%	0.687	46%	0.461	S	S	*	.	H	α-helix	trans	-63.1	-50.6	-175.9	-168.2	174.3	-173.6	-177.3	2	113.7	R162 Q167 R168	R162-R164 PolarHBondContact O-N 3.32Å; R164-Q167 PolarHBondContact O-N 3.28Å; R164-R168 PolarHBondContact O-N 3.42Å
165	P	96.7	Very high	93.9	Very high	65 Å²	65	96.3 Å²	96.3	42%	0.422	46%	0.46	S	S	.	.	H	α-helix	trans	-65.3	-38.4	175.4	22.9	-32.2	0	0	0	112.5	R162 Q167 R168 V169	R162-P165 HydrophobicContact CB-CG 3.62Å; R162-P165 WeakPolarHBondContact O-CD 3.35Å; R162-P165 VanDerWaalsContact O-CG 3.24Å; R162-P165 WeakPolarHBondContact O-CG 3.45Å; P165-Q167 VanDerWaalsContact C-N 3.35Å; P165-Q167 PolarHBondContact O-N 2.83Å; P165-R168 WeakPolarHBondContact O-CB 3.48Å; P165-R168 PolarHBondContact O-N 3.3Å; P165-R168 VanDerWaalsContact O-N 3.12Å; P165-V169 PolarHBondContact O-N 2.82Å; P165-V169 VanDerWaalsContact O-N 3.12Å
166	F	96.5	Very high	93.9	Very high	30 Å²	30	96.6 Å²	96.6	13%	0.132	46%	0.456	C	S	.	.	H	α-helix	trans	-58.9	-46.1	175.9	-175.2	-98.2	0	0	0	111.9	I161 R162 R163 R168 V169 V170 L192 Q193 A196	I161-F166 HydrophobicContact CG2-CB 3.99Å; I161-F166 HydrophobicContact CG2-CD2 4.34Å; R162-F166 PolarHBondContact O-N 3.46Å; R163-F166 PolarHBondContact O-N 2.79Å; F166-R168 VanDerWaalsContact C-N 3.28Å; F166-R168 PolarHBondContact O-N 3.35Å; F166-V169 PolarHBondContact O-N 3.04Å; F166-V169 VanDerWaalsContact O-N 3.16Å; F166-V170 HydrophobicContact CD1-CG2 3.93Å; F166-V170 HydrophobicContact CE1-CG2 3.48Å; F166-V170 VanDerWaalsContact CE1-CG2 3.48Å; F166-V170 HydrophobicContact CE2-CG2 4.48Å; F166-V170 HydrophobicContact CZ-CG2 3.79Å; F166-V170 WeakPolarHBondContact O-CG2 3.44Å; F166-V170 PolarHBondContact O-N 3.42Å; F166-L192 HydrophobicContact CE1-CB 4.14Å; F166-L192 HydrophobicContact CZ-CB 4.27Å; F166-Q193 HydrophobicContact CD1-CB 3.71Å; F166-Q193 HydrophobicContact CD1-CG 3.96Å; F166-Q193 HydrophobicContact CD2-CG 4.37Å; F166-Q193 VanDerWaalsContact CE1-CA 3.41Å; F166-Q193 HydrophobicContact CE1-CB 3.48Å; F166-Q193 VanDerWaalsContact CE1-CB 3.48Å; F166-Q193 HydrophobicContact CE1-CG 4.09Å; F166-Q193 HydrophobicContact CE2-CG 4.48Å; F166-Q193 HydrophobicContact CG-CB 4.36Å; F166-Q193 HydrophobicContact CG-CG 4.11Å; F166-Q193 VanDerWaalsContact CZ-CA 3.4Å; F166-Q193 HydrophobicContact CZ-CB 3.95Å; F166-Q193 HydrophobicContact CZ-CG 4.36Å; F166-A196 HydrophobicContact CE2-CB 3.95Å; F166-A196 HydrophobicContact CZ-CB 4.11Å
167	Q	94.3	Very high	94	Very high	77 Å²	77	101.7 Å²	101.7	36%	0.36	47%	0.47	S	S	.	.	H	α-helix	trans	-59.5	-36.3	175.8	175.4	176.8	-17.6	0	0	112.9	R163 R164 P165 R171 L189	R163-Q167 WeakPolarHBondContact O-CB 3.18Å; R163-Q167 PolarHBondContact O-N 2.9Å; R164-Q167 PolarHBondContact O-N 3.28Å; P165-Q167 VanDerWaalsContact C-N 3.35Å; P165-Q167 PolarHBondContact O-N 2.83Å; Q167-R171 WeakPolarHBondContact O-CG 3.41Å; Q167-R171 PolarHBondContact O-N 3.08Å; Q167-L189 HydrophobicContact CB-CD1 4.5Å; Q167-L189 HydrophobicContact CG-CD1 3.86Å
168	R	94.8	Very high	93.6	Very high	161 Å²	161	98 Å²	98	61%	0.608	46%	0.459	S	S	*	.	H	α-helix	trans	-64.6	-44.5	176	-70.3	-178.9	-173.2	-96.7	7.5	110.9	R164 P165 F166 R171 D172	R164-R168 PolarHBondContact O-N 3.42Å; P165-R168 WeakPolarHBondContact O-CB 3.48Å; P165-R168 PolarHBondContact O-N 3.3Å; P165-R168 VanDerWaalsContact O-N 3.12Å; F166-R168 VanDerWaalsContact C-N 3.28Å; F166-R168 PolarHBondContact O-N 3.35Å; R168-R171 PolarHBondContact O-N 3.14Å; R168-D172 PolarHBondContact O-N 3.39Å
169	V	95.7	Very high	93.2	Very high	83 Å²	83	98 Å²	98	50%	0.503	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-44.7	177.9	175.8	0	0	0	0	111.4	P165 F166 R171 D172 V173	P165-V169 PolarHBondContact O-N 2.82Å; P165-V169 VanDerWaalsContact O-N 3.12Å; F166-V169 PolarHBondContact O-N 3.04Å; F166-V169 VanDerWaalsContact O-N 3.16Å; V169-R171 VanDerWaalsContact C-N 3.26Å; V169-R171 PolarHBondContact O-N 3Å; V169-D172 PolarHBondContact O-N 2.88Å; V169-V173 HydrophobicContact CG1-CG2 4.32Å; V169-V173 WeakPolarHBondContact O-CG2 3.22Å; V169-V173 PolarHBondContact O-N 3.37Å
170	V	94.2	Very high	92.6	Very high	21 Å²	21	99.9 Å²	99.9	13%	0.127	47%	0.473	C	S	.	.	H	α-helix	trans	-59.2	-39.6	177.9	173.5	0	0	0	0	111.5	F166 A174 F184 L189 L192	F166-V170 HydrophobicContact CD1-CG2 3.93Å; F166-V170 HydrophobicContact CE1-CG2 3.48Å; F166-V170 VanDerWaalsContact CE1-CG2 3.48Å; F166-V170 HydrophobicContact CE2-CG2 4.48Å; F166-V170 HydrophobicContact CZ-CG2 3.79Å; F166-V170 WeakPolarHBondContact O-CG2 3.44Å; F166-V170 PolarHBondContact O-N 3.42Å; V170-A174 WeakPolarHBondContact O-CB 3.34Å; V170-A174 PolarHBondContact O-N 3.35Å; V170-F184 HydrophobicContact CG1-CD1 4.37Å; V170-F184 HydrophobicContact CG1-CE1 3.9Å; V170-F184 HydrophobicContact CG1-CZ 4.01Å; V170-L189 HydrophobicContact CB-CD2 4.22Å; V170-L189 HydrophobicContact CG1-CD2 3.78Å; V170-L192 HydrophobicContact CG1-CD1 3.87Å
171	R	93.2	Very high	92.2	Very high	95 Å²	95	103.8 Å²	103.8	36%	0.358	49%	0.489	S	S	.	.	H	α-helix	trans	-71.7	-39.7	178	-70	176.7	-171.9	-85.7	2.5	112.6	Q167 R168 V169 A174 Q175 F184	Q167-R171 WeakPolarHBondContact O-CG 3.41Å; Q167-R171 PolarHBondContact O-N 3.08Å; R168-R171 PolarHBondContact O-N 3.14Å; V169-R171 VanDerWaalsContact C-N 3.26Å; V169-R171 PolarHBondContact O-N 3Å; R171-A174 PolarHBondContact O-N 3.44Å; R171-Q175 WeakPolarHBondContact O-CB 3.45Å; R171-Q175 PolarHBondContact O-N 3.11Å; R171-F184 HydrophobicContact CG-CD2 4.32Å; R171-F184 HydrophobicContact CG-CE2 4.29Å
172	D	94.1	Very high	91.8	Very high	61 Å²	61	104.5 Å²	104.5	33%	0.326	49%	0.493	S	S	.	.	H	α-helix	trans	-60.5	-46.2	173.7	178.3	34.7	0	0	0	111.2	R168 V169 A174 Q175 R176	R168-D172 PolarHBondContact O-N 3.39Å; V169-D172 PolarHBondContact O-N 2.88Å; D172-A174 PolarHBondContact O-N 3.25Å; D172-Q175 WeakPolarHBondContact O-CB 3.09Å; D172-Q175 PolarHBondContact O-N 3.09Å; D172-R176 WeakPolarHBondContact O-CG 3.2Å; D172-R176 PolarHBondContact O-N 3.35Å; D172-R176 IonicContact OD1-CZ 3.09Å; D172-R176 IonicContact OD1-NE 3.08Å; D172-R176 PolarHBondContact OD1-NE 2.97Å; D172-R176 VanDerWaalsContact OD1-NE 3.08Å; D172-R176 IonicContact OD1-NH2 3.16Å; D172-R176 IonicContact OD2-CZ 2.88Å; D172-R176 VanDerWaalsContact OD2-CZ 3.31Å; D172-R176 IonicContact OD2-NE 3.7Å; D172-R176 PolarHBondContact OD2-NE 2.99Å; D172-R176 IonicContact OD2-NH2 3.94Å; D172-R176 PolarHBondContact OD2-NH2 2.88Å
173	V	94.1	Very high	91.6	Very high	64 Å²	64	104.1 Å²	104.1	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-44.4	175.1	172.9	0	0	0	0	111.5	V169 Q175 R176 H177	V169-V173 HydrophobicContact CG1-CG2 4.32Å; V169-V173 WeakPolarHBondContact O-CG2 3.22Å; V169-V173 PolarHBondContact O-N 3.37Å; V173-Q175 VanDerWaalsContact C-N 3.3Å; V173-Q175 PolarHBondContact O-N 3.42Å; V173-R176 PolarHBondContact O-N 3.34Å; V173-H177 PolarHBondContact O-CD2 3.21Å; V173-H177 PolarHBondContact O-N 2.75Å; V173-H177 VanDerWaalsContact O-N 3.07Å
174	A	92.6	Very high	91.5	Very high	14 Å²	14	100.4 Å²	100.4	12%	0.116	48%	0.484	C	S	.	.	H	α-helix	trans	-62.5	-37.1	177.2	0	0	0	0	0	113	V170 R171 D172 H177 K179 L182 F184	V170-A174 WeakPolarHBondContact O-CB 3.34Å; V170-A174 PolarHBondContact O-N 3.35Å; R171-A174 PolarHBondContact O-N 3.44Å; D172-A174 PolarHBondContact O-N 3.25Å; A174-H177 PolarHBondContact O-N 3.47Å; A174-K179 PolarHBondContact O-N 3.3Å; A174-L182 HydrophobicContact CB-CD1 4.37Å; A174-F184 HydrophobicContact CB-CE2 4Å; A174-F184 HydrophobicContact CB-CZ 3.71Å
175	Q	92.4	Very high	91.5	Very high	130 Å²	130	97.6 Å²	97.6	61%	0.607	48%	0.479	S	S	*	.	H	α-helix	trans	-65.3	-44.1	174.5	-175.2	176.3	-3.7	0	0	111.2	R171 D172 V173 H177 G178	R171-Q175 WeakPolarHBondContact O-CB 3.45Å; R171-Q175 PolarHBondContact O-N 3.11Å; D172-Q175 WeakPolarHBondContact O-CB 3.09Å; D172-Q175 PolarHBondContact O-N 3.09Å; V173-Q175 VanDerWaalsContact C-N 3.3Å; V173-Q175 PolarHBondContact O-N 3.42Å; Q175-H177 VanDerWaalsContact C-N 3.26Å; Q175-H177 PolarHBondContact O-N 3.34Å; Q175-G178 PolarHBondContact O-N 3.22Å; Q175-G178 VanDerWaalsContact O-N 3.09Å
176	R	92.8	Very high	91.2	Very high	188 Å²	188	102.2 Å²	102.2	71%	0.709	49%	0.488	S	S	*	.	H	α-helix	trans	-63.2	-28.9	176.4	-67.4	173.9	-166.5	-154.8	5.4	113.4	D172 V173 G178	D172-R176 WeakPolarHBondContact O-CG 3.2Å; D172-R176 PolarHBondContact O-N 3.35Å; D172-R176 IonicContact OD1-CZ 3.09Å; D172-R176 IonicContact OD1-NE 3.08Å; D172-R176 PolarHBondContact OD1-NE 2.97Å; D172-R176 VanDerWaalsContact OD1-NE 3.08Å; D172-R176 IonicContact OD1-NH2 3.16Å; D172-R176 IonicContact OD2-CZ 2.88Å; D172-R176 VanDerWaalsContact OD2-CZ 3.31Å; D172-R176 IonicContact OD2-NE 3.7Å; D172-R176 PolarHBondContact OD2-NE 2.99Å; D172-R176 IonicContact OD2-NH2 3.94Å; D172-R176 PolarHBondContact OD2-NH2 2.88Å; V173-R176 PolarHBondContact O-N 3.34Å; R176-G178 PolarHBondContact O-N 2.9Å
177	H	90.9	Very high	91.1	Very high	142 Å²	142	103.8 Å²	103.8	66%	0.657	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	11.8	174.8	-71.3	-63.6	0	0	0	114.3	V173 A174 Q175	V173-H177 PolarHBondContact O-CD2 3.21Å; V173-H177 PolarHBondContact O-N 2.75Å; V173-H177 VanDerWaalsContact O-N 3.07Å; A174-H177 PolarHBondContact O-N 3.47Å; Q175-H177 VanDerWaalsContact C-N 3.26Å; Q175-H177 PolarHBondContact O-N 3.34Å
178	G	84.9	Confident	91.1	Very high	62 Å²	62	102 Å²	102	64%	0.639	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	20.3	173.3	0	0	0	0	0	114.8	Q175 R176 P180	Q175-G178 PolarHBondContact O-N 3.22Å; Q175-G178 VanDerWaalsContact O-N 3.09Å; R176-G178 PolarHBondContact O-N 2.9Å; G178-P180 VanDerWaalsContact C-CD 3.4Å; G178-P180 WeakPolarHBondContact O-CD 3.37Å
179	K	84.5	Confident	91	Very high	129 Å²	129	95.1 Å²	95.1	56%	0.561	47%	0.471	S	S	*	.			trans	-123.8	65.1	-179.4	-62.1	-177	-176.5	178.8	0	111.8	A174 E181 L182	A174-K179 PolarHBondContact O-N 3.3Å; K179-E181 VanDerWaalsContact C-N 3.25Å; K179-E181 PolarHBondContact O-N 3.3Å; K179-L182 HydrophobicContact CB-CD1 3.3Å; K179-L182 HydrophobicContact CB-CG 3.84Å; K179-L182 HydrophobicContact CD-CD1 3.61Å; K179-L182 HydrophobicContact CD-CG 4.39Å; K179-L182 HydrophobicContact CG-CD1 4.1Å; K179-L182 PolarHBondContact O-N 3.01Å
180	P	80.8	Confident	91	Very high	99 Å²	99	93.1 Å²	93.1	64%	0.643	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.1	-174.5	26.7	-34.2	0	0	0	113.6	G178 L182	G178-P180 VanDerWaalsContact C-CD 3.4Å; G178-P180 WeakPolarHBondContact O-CD 3.37Å; P180-L182 VanDerWaalsContact C-N 3.32Å; P180-L182 PolarHBondContact O-N 3.43Å
181	E	84.6	Confident	91	Very high	179 Å²	179	94.2 Å²	94.2	84%	0.836	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	2.9	-174.5	-61.9	178.8	-177.7	0	0	114	K179 K183	K179-E181 VanDerWaalsContact C-N 3.25Å; K179-E181 PolarHBondContact O-N 3.3Å; E181-K183 PolarHBondContact O-N 3.34Å
182	L	87.8	Confident	91.1	Very high	77 Å²	77	93.6 Å²	93.6	40%	0.403	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-63.9	119	-178.7	-88.6	166.4	0	0	0	112.3	A174 K179 P180 F184	A174-L182 HydrophobicContact CB-CD1 4.37Å; K179-L182 HydrophobicContact CB-CD1 3.3Å; K179-L182 HydrophobicContact CB-CG 3.84Å; K179-L182 HydrophobicContact CD-CD1 3.61Å; K179-L182 HydrophobicContact CD-CG 4.39Å; K179-L182 HydrophobicContact CG-CD1 4.1Å; K179-L182 PolarHBondContact O-N 3.01Å; P180-L182 VanDerWaalsContact C-N 3.32Å; P180-L182 PolarHBondContact O-N 3.43Å; L182-F184 HydrophobicContact CB-CE2 4.09Å; L182-F184 HydrophobicContact CB-CZ 4.39Å
183	K	91.1	Very high	91.2	Very high	199 Å²	199	91 Å²	91	87%	0.865	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-89.3	128.9	168.1	-64.6	179.7	-177.6	174.8	0	109.3	E181	E181-K183 PolarHBondContact O-N 3.34Å
184	F	90.4	Very high	91.2	Very high	51 Å²	51	90 Å²	90	22%	0.224	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-101.7	128.9	177.5	-69	-89.2	0	0	0	110.6	V170 R171 A174 L182 L189	V170-F184 HydrophobicContact CG1-CD1 4.37Å; V170-F184 HydrophobicContact CG1-CE1 3.9Å; V170-F184 HydrophobicContact CG1-CZ 4.01Å; R171-F184 HydrophobicContact CG-CD2 4.32Å; R171-F184 HydrophobicContact CG-CE2 4.29Å; A174-F184 HydrophobicContact CB-CE2 4Å; A174-F184 HydrophobicContact CB-CZ 3.71Å; L182-F184 HydrophobicContact CB-CE2 4.09Å; L182-F184 HydrophobicContact CB-CZ 4.39Å; F184-L189 HydrophobicContact CB-CD1 4.07Å; F184-L189 HydrophobicContact CB-CD2 3.88Å; F184-L189 HydrophobicContact CB-CG 3.84Å; F184-L189 HydrophobicContact CD1-CD2 3.97Å; F184-L189 HydrophobicContact CG-CD2 3.93Å; F184-L189 HydrophobicContact CG-CG 4.43Å
185	Q	94.2	Very high	91.3	Very high	123 Å²	123	92.2 Å²	92.2	58%	0.575	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-67.2	147	166.3	-167.6	178.9	5.5	0	0	109.9	I187 A188 L189	Q185-I187 VanDerWaalsContact C-N 3.26Å; Q185-I187 HydrophobicContact CG-CB 4.43Å; Q185-I187 PolarHBondContact O-N 3.3Å; Q185-A188 HydrophobicContact CB-CB 4.18Å; Q185-A188 WeakPolarHBondContact O-CB 3.49Å; Q185-A188 PolarHBondContact O-N 2.91Å; Q185-A188 VanDerWaalsContact O-N 3.13Å; Q185-L189 PolarHBondContact O-N 2.88Å
186	R	91.5	Very high	91.5	Very high	162 Å²	162	87.5 Å²	87.5	61%	0.611	45%	0.452	S	S	*	.	H	α-helix	trans	-53.4	-44.4	175.2	177.9	177.9	174.2	-88	3	112	A188 L189 E190	R186-A188 VanDerWaalsContact C-N 3.35Å; R186-A188 PolarHBondContact O-N 3.41Å; R186-L189 PolarHBondContact O-N 3.25Å; R186-E190 IonicContact CZ-OE1 3.17Å; R186-E190 IonicContact NE-OE1 3.68Å; R186-E190 IonicContact NH1-OE1 3.43Å; R186-E190 PolarHBondContact NH1-OE1 3.26Å; R186-E190 IonicContact NH1-OE2 3.52Å; R186-E190 IonicContact NH2-OE1 3.15Å; R186-E190 PolarHBondContact NH2-OE1 2.93Å; R186-E190 VanDerWaalsContact NH2-OE1 3.15Å; R186-E190 PolarHBondContact O-N 2.9Å; R186-E190 VanDerWaalsContact O-N 3.07Å
187	I	94.1	Very high	91.6	Very high	62 Å²	62	79.1 Å²	79.1	32%	0.318	42%	0.421	S	S	.	.	H	α-helix	trans	-64.8	-39.5	-179.6	-59.3	176.8	0	0	0	111.2	V62 Q185 L189 E190 A191	V62-I187 HydrophobicContact CB-CG2 4.4Å; V62-I187 HydrophobicContact CG1-CG2 3.58Å; V62-I187 HydrophobicContact CG2-CD1 4.46Å; V62-I187 HydrophobicContact CG2-CG2 3.84Å; Q185-I187 VanDerWaalsContact C-N 3.26Å; Q185-I187 HydrophobicContact CG-CB 4.43Å; Q185-I187 PolarHBondContact O-N 3.3Å; I187-L189 VanDerWaalsContact C-N 3.32Å; I187-L189 PolarHBondContact O-N 3.24Å; I187-E190 PolarHBondContact O-N 3.37Å; I187-A191 WeakPolarHBondContact O-CB 3.47Å; I187-A191 PolarHBondContact O-N 3.11Å
188	A	94.1	Very high	91.8	Very high	39 Å²	39	74.9 Å²	74.9	32%	0.322	41%	0.411	S	S	.	.	H	α-helix	trans	-62	-40.6	177.4	0	0	0	0	0	111.7	Q185 R186 A191 L192	Q185-A188 HydrophobicContact CB-CB 4.18Å; Q185-A188 WeakPolarHBondContact O-CB 3.49Å; Q185-A188 PolarHBondContact O-N 2.91Å; Q185-A188 VanDerWaalsContact O-N 3.13Å; R186-A188 VanDerWaalsContact C-N 3.35Å; R186-A188 PolarHBondContact O-N 3.41Å; A188-A191 PolarHBondContact O-N 3.39Å; A188-L192 WeakPolarHBondContact O-CG 3.13Å; A188-L192 PolarHBondContact O-N 3.26Å
189	L	93.8	Very high	92.3	Very high	18 Å²	18	76.2 Å²	76.2	9%	0.094	40%	0.397	C	S	.	.	H	α-helix	trans	-66	-40.7	175.1	-66.3	173.2	0	0	0	112.2	Q167 V170 F184 Q185 R186 I187 L192 Q193	Q167-L189 HydrophobicContact CB-CD1 4.5Å; Q167-L189 HydrophobicContact CG-CD1 3.86Å; V170-L189 HydrophobicContact CB-CD2 4.22Å; V170-L189 HydrophobicContact CG1-CD2 3.78Å; F184-L189 HydrophobicContact CB-CD1 4.07Å; F184-L189 HydrophobicContact CB-CD2 3.88Å; F184-L189 HydrophobicContact CB-CG 3.84Å; F184-L189 HydrophobicContact CD1-CD2 3.97Å; F184-L189 HydrophobicContact CG-CD2 3.93Å; F184-L189 HydrophobicContact CG-CG 4.43Å; Q185-L189 PolarHBondContact O-N 2.88Å; R186-L189 PolarHBondContact O-N 3.25Å; I187-L189 VanDerWaalsContact C-N 3.32Å; I187-L189 PolarHBondContact O-N 3.24Å; L189-L192 PolarHBondContact O-N 3.09Å; L189-Q193 WeakPolarHBondContact O-CB 3.45Å; L189-Q193 PolarHBondContact O-N 2.76Å
190	E	94.2	Very high	92.8	Very high	41 Å²	41	74 Å²	74	19%	0.192	39%	0.391	C	S	.	.	H	α-helix	trans	-65.1	-38.6	175.9	-71.6	179.8	159.3	0	0	111.9	R163 R186 I187 Q193 T194	R163-E190 IonicContact CZ-OE1 3.56Å; R163-E190 VanDerWaalsContact CZ-OE1 3.22Å; R163-E190 IonicContact NH1-OE1 2.68Å; R163-E190 PolarHBondContact NH1-OE1 3.31Å; R163-E190 IonicContact NH2-OE1 3.08Å; R163-E190 PolarHBondContact NH2-OE1 2.94Å; R163-E190 VanDerWaalsContact NH2-OE1 3.09Å; R186-E190 IonicContact CZ-OE1 3.17Å; R186-E190 IonicContact NE-OE1 3.68Å; R186-E190 IonicContact NH1-OE1 3.43Å; R186-E190 PolarHBondContact NH1-OE1 3.26Å; R186-E190 IonicContact NH1-OE2 3.52Å; R186-E190 IonicContact NH2-OE1 3.15Å; R186-E190 PolarHBondContact NH2-OE1 2.93Å; R186-E190 VanDerWaalsContact NH2-OE1 3.15Å; R186-E190 PolarHBondContact O-N 2.9Å; R186-E190 VanDerWaalsContact O-N 3.07Å; I187-E190 PolarHBondContact O-N 3.37Å; E190-Q193 PolarHBondContact O-N 3.14Å; E190-T194 WeakPolarHBondContact O-CB 3.38Å; E190-T194 PolarHBondContact O-N 2.69Å; E190-T194 PolarHBondContact O-OG1 3.23Å
191	A	94.4	Very high	93.5	Very high	44 Å²	44	73.4 Å²	73.4	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-65.5	-46.1	175.7	0	0	0	0	0	111.8	I187 A188 Q193 T194 A195	I187-A191 WeakPolarHBondContact O-CB 3.47Å; I187-A191 PolarHBondContact O-N 3.11Å; A188-A191 PolarHBondContact O-N 3.39Å; A191-Q193 VanDerWaalsContact C-N 3.29Å; A191-Q193 PolarHBondContact O-N 3.2Å; A191-T194 PolarHBondContact O-N 3.44Å; A191-A195 WeakPolarHBondContact O-CB 3.21Å; A191-A195 PolarHBondContact O-N 3.14Å
192	L	95.2	Very high	93.9	Very high	82 Å²	82	65.8 Å²	65.8	43%	0.429	35%	0.351	S	S	.	.	H	α-helix	trans	-59.4	-41.7	174.4	-74.2	173.1	0	0	0	111.6	F166 V170 A188 L189 A195 A196	F166-L192 HydrophobicContact CE1-CB 4.14Å; F166-L192 HydrophobicContact CZ-CB 4.27Å; V170-L192 HydrophobicContact CG1-CD1 3.87Å; A188-L192 WeakPolarHBondContact O-CG 3.13Å; A188-L192 PolarHBondContact O-N 3.26Å; L189-L192 PolarHBondContact O-N 3.09Å; L192-A195 PolarHBondContact O-N 2.51Å; L192-A196 VanDerWaalsContact O-CB 3.26Å; L192-A196 WeakPolarHBondContact O-CB 3.34Å; L192-A196 PolarHBondContact O-N 3.08Å
193	Q	95.8	Very high	94.2	Very high	5 Å²	5	62.7 Å²	62.7	2%	0.023	34%	0.335	C	S	.	.	H	α-helix	trans	-64.6	-46.9	178	-170.8	174.5	-19.3	0	0	111.6	L159 I161 F166 L189 E190 A191 A195 A196 E197	L159-Q193 HydrophobicContact CD1-CG 4.26Å; L159-Q193 HydrophobicContact CD2-CG 4.47Å; I161-Q193 PolarHBondContact O-NE2 3.29Å; F166-Q193 HydrophobicContact CD1-CB 3.71Å; F166-Q193 HydrophobicContact CD1-CG 3.96Å; F166-Q193 HydrophobicContact CD2-CG 4.37Å; F166-Q193 VanDerWaalsContact CE1-CA 3.41Å; F166-Q193 HydrophobicContact CE1-CB 3.48Å; F166-Q193 VanDerWaalsContact CE1-CB 3.48Å; F166-Q193 HydrophobicContact CE1-CG 4.09Å; F166-Q193 HydrophobicContact CE2-CG 4.48Å; F166-Q193 HydrophobicContact CG-CB 4.36Å; F166-Q193 HydrophobicContact CG-CG 4.11Å; F166-Q193 VanDerWaalsContact CZ-CA 3.4Å; F166-Q193 HydrophobicContact CZ-CB 3.95Å; F166-Q193 HydrophobicContact CZ-CG 4.36Å; L189-Q193 WeakPolarHBondContact O-CB 3.45Å; L189-Q193 PolarHBondContact O-N 2.76Å; E190-Q193 PolarHBondContact O-N 3.14Å; A191-Q193 VanDerWaalsContact C-N 3.29Å; A191-Q193 PolarHBondContact O-N 3.2Å; Q193-A195 VanDerWaalsContact C-N 3.32Å; Q193-A195 PolarHBondContact O-N 3.28Å; Q193-A196 PolarHBondContact O-N 2.88Å; Q193-E197 PolarHBondContact NE2-OE1 3.38Å; Q193-E197 WeakPolarHBondContact O-CG 3.41Å; Q193-E197 PolarHBondContact O-N 3.18Å
194	T	94.4	Very high	94.4	Very high	44 Å²	44	57.1 Å²	57.1	27%	0.27	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-43.6	179.3	-54.4	0	0	0	0	111.1	F69 E190 A191 A198	F69-T194 HydrophobicContact CD2-CG2 4.38Å; F69-T194 HydrophobicContact CE2-CG2 3.73Å; F69-T194 HydrophobicContact CZ-CG2 4.05Å; E190-T194 WeakPolarHBondContact O-CB 3.38Å; E190-T194 PolarHBondContact O-N 2.69Å; E190-T194 PolarHBondContact O-OG1 3.23Å; A191-T194 PolarHBondContact O-N 3.44Å; T194-A198 VanDerWaalsContact O-CB 3.27Å; T194-A198 WeakPolarHBondContact O-CB 3.47Å; T194-A198 PolarHBondContact O-N 2.91Å
195	A	95.9	Very high	94.6	Very high	60 Å²	60	60 Å²	60	50%	0.496	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-44.1	177.1	0	0	0	0	0	112.3	A191 L192 Q193 A198 Y199	A191-A195 WeakPolarHBondContact O-CB 3.21Å; A191-A195 PolarHBondContact O-N 3.14Å; L192-A195 PolarHBondContact O-N 2.51Å; Q193-A195 VanDerWaalsContact C-N 3.32Å; Q193-A195 PolarHBondContact O-N 3.28Å; A195-A198 PolarHBondContact O-N 3.39Å; A195-Y199 WeakPolarHBondContact O-CB 3.3Å; A195-Y199 PolarHBondContact O-N 3.24Å
196	A	96.2	Very high	94.6	Very high	31 Å²	31	57.2 Å²	57.2	26%	0.256	32%	0.316	S	S	.	.	H	α-helix	trans	-63.1	-46.1	178.6	0	0	0	0	0	112	F166 L192 Q193 Y199 L200	F166-A196 HydrophobicContact CE2-CB 3.95Å; F166-A196 HydrophobicContact CZ-CB 4.11Å; L192-A196 VanDerWaalsContact O-CB 3.26Å; L192-A196 WeakPolarHBondContact O-CB 3.34Å; L192-A196 PolarHBondContact O-N 3.08Å; Q193-A196 PolarHBondContact O-N 2.88Å; A196-Y199 PolarHBondContact O-N 2.92Å; A196-L200 WeakPolarHBondContact O-CG 3.45Å; A196-L200 PolarHBondContact O-N 3.07Å
197	E	95.2	Very high	94.8	Very high	12 Å²	12	49.6 Å²	49.6	6%	0.056	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-41.7	177	-71.5	-171.5	-152.4	0	0	111.8	L159 L160 I161 Q193 Y199 L200 I201	L159-E197 VanDerWaalsContact CA-OE2 3.29Å; L159-E197 WeakPolarHBondContact CA-OE2 3.38Å; L160-E197 PolarHBondContact N-OE1 3.17Å; L160-E197 PolarHBondContact N-OE2 3.48Å; I161-E197 VanDerWaalsContact CB-OE1 3.3Å; I161-E197 WeakPolarHBondContact CB-OE1 3.45Å; I161-E197 HydrophobicContact CD1-CG 3.73Å; I161-E197 HydrophobicContact CG1-CG 3.95Å; I161-E197 PolarHBondContact N-OE1 3.42Å; Q193-E197 PolarHBondContact NE2-OE1 3.38Å; Q193-E197 WeakPolarHBondContact O-CG 3.41Å; Q193-E197 PolarHBondContact O-N 3.18Å; E197-Y199 VanDerWaalsContact C-N 3.32Å; E197-Y199 PolarHBondContact O-N 3.28Å; E197-L200 PolarHBondContact O-N 2.95Å; E197-I201 WeakPolarHBondContact O-CB 3.48Å; E197-I201 WeakPolarHBondContact O-CD1 3.29Å; E197-I201 WeakPolarHBondContact O-CG1 3.42Å; E197-I201 PolarHBondContact O-N 3.5Å
198	A	94.8	Very high	94.9	Very high	54 Å²	54	50 Å²	50	45%	0.446	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-40.1	176	0	0	0	0	0	112.4	T194 A195 G202	T194-A198 VanDerWaalsContact O-CB 3.27Å; T194-A198 WeakPolarHBondContact O-CB 3.47Å; T194-A198 PolarHBondContact O-N 2.91Å; A195-A198 PolarHBondContact O-N 3.39Å; A198-G202 PolarHBondContact O-N 2.89Å; A198-G202 VanDerWaalsContact O-N 3.09Å
199	Y	95.1	Very high	94.9	Very high	90 Å²	90	53.4 Å²	53.4	35%	0.353	30%	0.303	S	S	.	.	H	α-helix	trans	-64.3	-47.1	175.2	171.7	-92.1	0	0	0	111.7	A195 A196 E197 I201 G202 L203 E233	A195-Y199 WeakPolarHBondContact O-CB 3.3Å; A195-Y199 PolarHBondContact O-N 3.24Å; A196-Y199 PolarHBondContact O-N 2.92Å; E197-Y199 VanDerWaalsContact C-N 3.32Å; E197-Y199 PolarHBondContact O-N 3.28Å; Y199-I201 PolarHBondContact O-N 3.32Å; Y199-G202 PolarHBondContact O-N 3.01Å; Y199-L203 HydrophobicContact CE1-CD2 4.39Å; Y199-L203 PolarHBondContact O-N 3.14Å; Y199-E233 WeakPolarHBondContact CE2-OE1 3.5Å; Y199-E233 WeakPolarHBondContact CE2-OE2 3.25Å; Y199-E233 PolarHBondContact OH-OE2 3.38Å
200	L	95.2	Very high	95	Very high	81 Å²	81	53.3 Å²	53.3	42%	0.424	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-41.4	178	-71.4	173.3	0	0	0	111.9	I161 A196 E197 L203 M204	I161-L200 HydrophobicContact CD1-CD1 4.32Å; A196-L200 WeakPolarHBondContact O-CG 3.45Å; A196-L200 PolarHBondContact O-N 3.07Å; E197-L200 PolarHBondContact O-N 2.95Å; L200-L203 PolarHBondContact O-N 3.47Å; L200-M204 WeakPolarHBondContact O-CB 3.45Å; L200-M204 WeakPolarHBondContact O-CG 3.25Å; L200-M204 PolarHBondContact O-N 3.5Å
201	I	94.7	Very high	95	Very high	87 Å²	87	51.3 Å²	51.3	45%	0.446	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-46.3	176	-67.9	162.5	0	0	0	110.3	E197 Y199 M204 E205	E197-I201 WeakPolarHBondContact O-CB 3.48Å; E197-I201 WeakPolarHBondContact O-CD1 3.29Å; E197-I201 WeakPolarHBondContact O-CG1 3.42Å; E197-I201 PolarHBondContact O-N 3.5Å; Y199-I201 PolarHBondContact O-N 3.32Å; I201-M204 PolarHBondContact O-N 3.09Å; I201-E205 WeakPolarHBondContact O-CG 3.01Å; I201-E205 PolarHBondContact O-N 3.15Å
202	G	93.8	Very high	95.1	Very high	20 Å²	20	53 Å²	53	21%	0.206	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-45.6	176.9	0	0	0	0	0	112.8	A198 Y199 M204 E205 D206	A198-G202 PolarHBondContact O-N 2.89Å; A198-G202 VanDerWaalsContact O-N 3.09Å; Y199-G202 PolarHBondContact O-N 3.01Å; G202-M204 VanDerWaalsContact C-N 3.29Å; G202-M204 PolarHBondContact O-N 3.27Å; G202-E205 WeakPolarHBondContact O-CB 3.25Å; G202-E205 PolarHBondContact O-N 3.19Å; G202-D206 PolarHBondContact O-N 3.46Å; G202-D206 VanDerWaalsContact O-N 3.14Å
203	L	94.5	Very high	95.1	Very high	11 Å²	11	57 Å²	57	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-38.6	176.1	179.2	60.7	0	0	0	112.1	Y199 L200 D206 T207 M224 A227 L228	Y199-L203 HydrophobicContact CE1-CD2 4.39Å; Y199-L203 PolarHBondContact O-N 3.14Å; L200-L203 PolarHBondContact O-N 3.47Å; L203-D206 PolarHBondContact O-N 3.1Å; L203-T207 VanDerWaalsContact O-CB 3.3Å; L203-T207 WeakPolarHBondContact O-CB 3.34Å; L203-T207 PolarHBondContact O-N 3.01Å; L203-T207 PolarHBondContact O-OG1 3.17Å; L203-M224 HydrophobicContact CD1-CG 4.37Å; L203-M224 HydrophobicContact CD2-CG 4.11Å; L203-M224 HydrophobicContact CD2-SD 4.39Å; L203-M224 HydrophobicContact CG-CG 4.33Å; L203-A227 HydrophobicContact CD1-CB 4.02Å; L203-L228 HydrophobicContact CD1-CD2 3.65Å; L203-L228 HydrophobicContact CD1-CG 3.87Å; L203-L228 HydrophobicContact CD2-CD2 4.06Å
204	M	94.8	Very high	95.1	Very high	82 Å²	82	59 Å²	59	40%	0.404	33%	0.33	S	S	.	.	H	α-helix	trans	-72.5	-31.7	178.8	-69	-69.7	-70.3	0	0	112.5	L200 I201 G202 N208 I219	L200-M204 WeakPolarHBondContact O-CB 3.45Å; L200-M204 WeakPolarHBondContact O-CG 3.25Å; L200-M204 PolarHBondContact O-N 3.5Å; I201-M204 PolarHBondContact O-N 3.09Å; G202-M204 VanDerWaalsContact C-N 3.29Å; G202-M204 PolarHBondContact O-N 3.27Å; M204-N208 VanDerWaalsContact O-CB 3.25Å; M204-N208 WeakPolarHBondContact O-CB 3.43Å; M204-N208 PolarHBondContact O-N 2.91Å; M204-I219 HydrophobicContact CE-CD1 3.33Å; M204-I219 HydrophobicContact SD-CD1 4.26Å
205	E	94.6	Very high	95.1	Very high	111 Å²	111	66.4 Å²	66.4	52%	0.519	36%	0.359	S	S	.	.	H	α-helix	trans	-60.9	-49.7	170.5	-74.2	173.7	-174	0	0	110.4	I201 G202 N208 L209	I201-E205 WeakPolarHBondContact O-CG 3.01Å; I201-E205 PolarHBondContact O-N 3.15Å; G202-E205 WeakPolarHBondContact O-CB 3.25Å; G202-E205 PolarHBondContact O-N 3.19Å; E205-N208 WeakPolarHBondContact O-CB 3.5Å; E205-N208 PolarHBondContact O-N 3.08Å; E205-L209 WeakPolarHBondContact O-CG 3.23Å; E205-L209 PolarHBondContact O-N 2.85Å; E205-L209 VanDerWaalsContact O-N 3.07Å
206	D	95	Very high	95.1	Very high	66 Å²	66	66 Å²	66	35%	0.353	34%	0.344	S	S	.	.	H	α-helix	trans	-64.4	-42.6	177.8	-67	-23.4	0	0	0	112	G202 L203 N208 L209 A210 A227	G202-D206 PolarHBondContact O-N 3.46Å; G202-D206 VanDerWaalsContact O-N 3.14Å; L203-D206 PolarHBondContact O-N 3.1Å; D206-N208 VanDerWaalsContact C-N 3.29Å; D206-N208 PolarHBondContact O-N 3.5Å; D206-L209 WeakPolarHBondContact O-CB 3.37Å; D206-L209 PolarHBondContact O-N 3.49Å; D206-A210 PolarHBondContact O-N 3.43Å; D206-A227 HydrophobicContact CB-CB 3.87Å
207	T	96.1	Very high	94.9	Very high	1 Å²	1	69.4 Å²	69.4	1%	0.006	36%	0.355	C	S	.	.	H	α-helix	trans	-61.4	-39	176.4	-59	0	0	0	0	111.4	L203 A210 S211 I219 D223 M224	L203-T207 VanDerWaalsContact O-CB 3.3Å; L203-T207 WeakPolarHBondContact O-CB 3.34Å; L203-T207 PolarHBondContact O-N 3.01Å; L203-T207 PolarHBondContact O-OG1 3.17Å; T207-A210 PolarHBondContact O-N 3.44Å; T207-S211 PolarHBondContact O-N 3.29Å; T207-I219 HydrophobicContact CG2-CB 4.07Å; T207-I219 HydrophobicContact CG2-CG2 4.02Å; T207-D223 HydrophobicContact CG2-CB 3.75Å; T207-M224 HydrophobicContact CG2-CB 4.2Å
208	N	95.4	Very high	94.9	Very high	71 Å²	71	73.4 Å²	73.4	38%	0.38	38%	0.381	S	S	.	.	H	α-helix	trans	-66.2	-41.3	176.1	-176.3	46.4	0	0	0	111.4	M204 E205 D206 A210 S211 I212	M204-N208 VanDerWaalsContact O-CB 3.25Å; M204-N208 WeakPolarHBondContact O-CB 3.43Å; M204-N208 PolarHBondContact O-N 2.91Å; E205-N208 WeakPolarHBondContact O-CB 3.5Å; E205-N208 PolarHBondContact O-N 3.08Å; D206-N208 VanDerWaalsContact C-N 3.29Å; D206-N208 PolarHBondContact O-N 3.5Å; N208-A210 VanDerWaalsContact C-N 3.34Å; N208-A210 PolarHBondContact O-N 3.02Å; N208-S211 PolarHBondContact O-N 2.95Å; N208-I212 VanDerWaalsContact O-CG1 3.31Å; N208-I212 WeakPolarHBondContact O-CG1 3.17Å; N208-I212 PolarHBondContact O-N 3.11Å
209	L	94.7	Very high	94.8	Very high	111 Å²	111	74.2 Å²	74.2	58%	0.581	38%	0.376	S	S	*	.	H	α-helix	trans	-61.5	-41.7	174	-66.9	176	0	0	0	111.9	E205 D206 I212 H213	E205-L209 WeakPolarHBondContact O-CG 3.23Å; E205-L209 PolarHBondContact O-N 2.85Å; E205-L209 VanDerWaalsContact O-N 3.07Å; D206-L209 WeakPolarHBondContact O-CB 3.37Å; D206-L209 PolarHBondContact O-N 3.49Å; L209-I212 PolarHBondContact O-N 3.44Å; L209-H213 WeakPolarHBondContact O-CB 3.26Å; L209-H213 PolarHBondContact O-N 3.38Å
210	A	94.9	Very high	94.9	Very high	15 Å²	15	72.9 Å²	72.9	12%	0.124	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-40.4	174.9	0	0	0	0	0	112.6	D206 T207 N208 H213 A214 D223 L226	D206-A210 PolarHBondContact O-N 3.43Å; T207-A210 PolarHBondContact O-N 3.44Å; N208-A210 VanDerWaalsContact C-N 3.34Å; N208-A210 PolarHBondContact O-N 3.02Å; A210-H213 WeakPolarHBondContact O-CB 3.31Å; A210-H213 PolarHBondContact O-N 2.76Å; A210-A214 PolarHBondContact O-N 3Å; A210-D223 HydrophobicContact CB-CB 4.04Å; A210-L226 HydrophobicContact CB-CD2 4.15Å
211	S	94.9	Very high	94.9	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62.8	-44.9	174	177.3	0	0	0	0	111.9	T207 N208 H213 A214 K215 R216 T218	T207-S211 PolarHBondContact O-N 3.29Å; N208-S211 PolarHBondContact O-N 2.95Å; S211-H213 VanDerWaalsContact C-N 3.31Å; S211-H213 PolarHBondContact O-N 2.84Å; S211-A214 CarbonylContact O-C 3.48Å; S211-A214 PolarHBondContact O-N 3.21Å; S211-A214 VanDerWaalsContact O-N 3.14Å; S211-K215 PolarHBondContact O-N 3.21Å; S211-R216 CarbonylContact C-O 3.25Å; S211-R216 VanDerWaalsContact C-O 3.25Å; S211-R216 PolarHBondContact O-N 3.29Å; S211-R216 VanDerWaalsContact O-O 3.05Å; S211-R216 VanDerWaalsContact OG-C 3.3Å; S211-R216 PolarHBondContact OG-O 3.05Å; S211-T218 PolarHBondContact OG-O 2.81Å
212	I	95.1	Very high	94.9	Very high	80 Å²	80	76.4 Å²	76.4	41%	0.41	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-40.1	178.2	-68.3	166.5	0	0	0	110.6	N208 L209 A214 K215	N208-I212 VanDerWaalsContact O-CG1 3.31Å; N208-I212 WeakPolarHBondContact O-CG1 3.17Å; N208-I212 PolarHBondContact O-N 3.11Å; L209-I212 PolarHBondContact O-N 3.44Å; I212-A214 PolarHBondContact O-N 2.91Å; I212-K215 WeakPolarHBondContact O-CA 3.46Å; I212-K215 PolarHBondContact O-N 3.19Å
213	H	95.5	Very high	95.1	Very high	165 Å²	165	75.7 Å²	75.7	76%	0.764	38%	0.38	S	S	*	.	H	α-helix	trans	-57.4	-38.8	175.1	-177.7	72.6	0	0	0	111.8	L209 A210 S211 K215	L209-H213 WeakPolarHBondContact O-CB 3.26Å; L209-H213 PolarHBondContact O-N 3.38Å; A210-H213 WeakPolarHBondContact O-CB 3.31Å; A210-H213 PolarHBondContact O-N 2.76Å; S211-H213 VanDerWaalsContact C-N 3.31Å; S211-H213 PolarHBondContact O-N 2.84Å; H213-K215 PolarHBondContact O-N 3.34Å
214	A	95.8	Very high	95.1	Very high	46 Å²	46	78.6 Å²	78.6	38%	0.38	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	16.1	175	0	0	0	0	0	114.5	A210 S211 I212 R216	A210-A214 PolarHBondContact O-N 3Å; S211-A214 CarbonylContact O-C 3.48Å; S211-A214 PolarHBondContact O-N 3.21Å; S211-A214 VanDerWaalsContact O-N 3.14Å; I212-A214 PolarHBondContact O-N 2.91Å; A214-R216 PolarHBondContact O-N 2.67Å
215	K	95.9	Very high	95.1	Very high	201 Å²	201	80 Å²	80	87%	0.874	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	29.5	-178.9	-55.7	178.2	-178.1	174.8	0	114.3	S211 I212 H213	S211-K215 PolarHBondContact O-N 3.21Å; I212-K215 WeakPolarHBondContact O-CA 3.46Å; I212-K215 PolarHBondContact O-N 3.19Å; H213-K215 PolarHBondContact O-N 3.34Å
216	R	95.7	Very high	95.1	Very high	50 Å²	50	78.5 Å²	78.5	19%	0.189	40%	0.395	C	S	.	.			trans	-116	149.4	177.5	-71.3	176.9	-73.3	105.9	-5.8	111.1	S211 A214 T218 R222 D223	S211-R216 CarbonylContact C-O 3.25Å; S211-R216 VanDerWaalsContact C-O 3.25Å; S211-R216 PolarHBondContact O-N 3.29Å; S211-R216 VanDerWaalsContact O-O 3.05Å; S211-R216 VanDerWaalsContact OG-C 3.3Å; S211-R216 PolarHBondContact OG-O 3.05Å; A214-R216 PolarHBondContact O-N 2.67Å; R216-T218 PolarHBondContact NH1-O 2.75Å; R216-R222 VanDerWaalsContact NE-NH2 3.17Å; R216-D223 IonicContact CZ-OD1 3.52Å; R216-D223 IonicContact CZ-OD2 3.62Å; R216-D223 IonicContact NH1-OD1 3.41Å; R216-D223 PolarHBondContact NH1-OD1 2.94Å; R216-D223 IonicContact NH1-OD2 2.75Å; R216-D223 PolarHBondContact NH1-OD2 2.98Å; R216-D223 IonicContact NH2-OD1 2.7Å; R216-D223 PolarHBondContact NH2-OD1 3.3Å; R216-D223 IonicContact NH2-OD2 3.57Å
217	Q	90.6	Very high	95.1	Very high	103 Å²	103	75.6 Å²	75.6	48%	0.481	38%	0.38	S	S	.	.	S	Bend	trans	-99.5	-11.4	170.8	-63.7	179.8	10.9	0	0	112.9	L100 Y101	L100-Q217 HydrophobicContact CD1-CG 4.44Å; L100-Q217 HydrophobicContact CD2-CG 4.49Å; Y101-Q217 PolarHBondContact OH-OE1 3.35Å
218	T	95.1	Very high	95.1	Very high	97 Å²	97	76.9 Å²	76.9	60%	0.595	39%	0.387	S	S	*	.	S	Bend	trans	-100.8	118.4	179	-51.3	0	0	0	0	109.1	S211 R216	S211-T218 PolarHBondContact OG-O 2.81Å; R216-T218 PolarHBondContact NH1-O 2.75Å
219	I	94.4	Very high	95.1	Very high	70 Å²	70	82.7 Å²	82.7	36%	0.359	40%	0.403	S	S	.	.			trans	-64.3	142.9	172.3	58.5	173.1	0	0	0	111	M204 T207	M204-I219 HydrophobicContact CE-CD1 3.33Å; M204-I219 HydrophobicContact SD-CD1 4.26Å; T207-I219 HydrophobicContact CG2-CB 4.07Å; T207-I219 HydrophobicContact CG2-CG2 4.02Å
220	M	96.1	Very high	95	Very high	63 Å²	63	84.2 Å²	84.2	31%	0.31	41%	0.411	S	S	.	.			trans	-131.8	158.2	178.6	-62.7	-172.1	-177.7	0	0	110.6	R222 D223 M224	M220-R222 HydrophobicContact CB-CG 3.98Å; M220-R222 PolarHBondContact O-N 2.92Å; M220-R222 VanDerWaalsContact O-N 3.11Å; M220-R222 PolarHBondContact SD-NH1 3.44Å; M220-R222 VanDerWaalsContact SD-NH1 3.41Å; M220-R222 PolarHBondContact SD-NH2 3.46Å; M220-D223 PolarHBondContact N-OD2 2.7Å; M220-D223 WeakPolarHBondContact O-CB 3.33Å; M220-D223 PolarHBondContact O-N 3.41Å; M220-M224 PolarHBondContact O-N 2.99Å
221	P	96	Very high	94.9	Very high	96 Å²	96	89 Å²	89	62%	0.623	43%	0.426	S	S	*	.	H	α-helix	trans	-53.9	-35.3	179	-28.3	35.8	0	0	0	113.6	D223 M224 H225	P221-D223 VanDerWaalsContact C-N 3.27Å; P221-D223 PolarHBondContact O-N 3.04Å; P221-M224 WeakPolarHBondContact O-CB 3.29Å; P221-M224 PolarHBondContact O-N 3.04Å; P221-H225 PolarHBondContact O-N 3.48Å; P221-H225 PolarHBondContact O-ND1 2.9Å
222	R	95.2	Very high	94.8	Very high	146 Å²	146	91.9 Å²	91.9	55%	0.551	46%	0.456	S	S	*	.	H	α-helix	trans	-60.8	-32.5	175.4	62.6	178.2	179.3	-123.2	8.6	114	R216 M220 M224 L226	R216-R222 VanDerWaalsContact NE-NH2 3.17Å; M220-R222 HydrophobicContact CB-CG 3.98Å; M220-R222 PolarHBondContact O-N 2.92Å; M220-R222 VanDerWaalsContact O-N 3.11Å; M220-R222 PolarHBondContact SD-NH1 3.44Å; M220-R222 VanDerWaalsContact SD-NH1 3.41Å; M220-R222 PolarHBondContact SD-NH2 3.46Å; R222-M224 VanDerWaalsContact C-N 3.34Å; R222-L226 WeakPolarHBondContact O-CB 3.21Å; R222-L226 PolarHBondContact O-N 2.95Å
223	D	96.2	Very high	94.4	Very high	5 Å²	5	92.1 Å²	92.1	3%	0.027	46%	0.455	C	S	.	.	H	α-helix	trans	-71.1	-37.1	178.9	-54.5	-38.9	0	0	0	109.8	T207 A210 R216 M220 P221 L226 A227	T207-D223 HydrophobicContact CG2-CB 3.75Å; A210-D223 HydrophobicContact CB-CB 4.04Å; R216-D223 IonicContact CZ-OD1 3.52Å; R216-D223 IonicContact CZ-OD2 3.62Å; R216-D223 IonicContact NH1-OD1 3.41Å; R216-D223 PolarHBondContact NH1-OD1 2.94Å; R216-D223 IonicContact NH1-OD2 2.75Å; R216-D223 PolarHBondContact NH1-OD2 2.98Å; R216-D223 IonicContact NH2-OD1 2.7Å; R216-D223 PolarHBondContact NH2-OD1 3.3Å; R216-D223 IonicContact NH2-OD2 3.57Å; M220-D223 PolarHBondContact N-OD2 2.7Å; M220-D223 WeakPolarHBondContact O-CB 3.33Å; M220-D223 PolarHBondContact O-N 3.41Å; P221-D223 VanDerWaalsContact C-N 3.27Å; P221-D223 PolarHBondContact O-N 3.04Å; D223-L226 PolarHBondContact O-N 2.81Å; D223-A227 PolarHBondContact O-N 3.39Å
224	M	94.8	Very high	93.4	Very high	71 Å²	71	91.4 Å²	91.4	35%	0.35	46%	0.457	S	S	.	.	H	α-helix	trans	-68.8	-42.7	175.9	-168.5	-173.3	-52	0	0	111.6	L203 T207 M220 P221 R222 L226 A227 L228	L203-M224 HydrophobicContact CD1-CG 4.37Å; L203-M224 HydrophobicContact CD2-CG 4.11Å; L203-M224 HydrophobicContact CD2-SD 4.39Å; L203-M224 HydrophobicContact CG-CG 4.33Å; T207-M224 HydrophobicContact CG2-CB 4.2Å; M220-M224 PolarHBondContact O-N 2.99Å; P221-M224 WeakPolarHBondContact O-CB 3.29Å; P221-M224 PolarHBondContact O-N 3.04Å; R222-M224 VanDerWaalsContact C-N 3.34Å; M224-L226 VanDerWaalsContact C-N 3.3Å; M224-L226 PolarHBondContact O-N 3.27Å; M224-A227 PolarHBondContact O-N 2.98Å; M224-L228 HydrophobicContact CG-CD1 4.34Å; M224-L228 WeakPolarHBondContact O-CG 3.25Å; M224-L228 PolarHBondContact O-N 3.48Å
225	H	95.6	Very high	93.3	Very high	113 Å²	113	93.7 Å²	93.7	52%	0.523	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-40.9	174.2	-74	83.7	0	0	0	111.7	P221 L228 R229	P221-H225 PolarHBondContact O-N 3.48Å; P221-H225 PolarHBondContact O-ND1 2.9Å; H225-L228 PolarHBondContact O-N 3.26Å; H225-R229 VanDerWaalsContact O-CB 3.29Å; H225-R229 WeakPolarHBondContact O-CB 3.28Å; H225-R229 PolarHBondContact O-N 3.38Å
226	L	94.9	Very high	93.2	Very high	78 Å²	78	88.1 Å²	88.1	41%	0.408	44%	0.439	S	S	.	.	H	α-helix	trans	-61.7	-46.8	174.7	179.4	63.4	0	0	0	111.3	A210 R222 D223 M224 L228 R229 L230	A210-L226 HydrophobicContact CB-CD2 4.15Å; R222-L226 WeakPolarHBondContact O-CB 3.21Å; R222-L226 PolarHBondContact O-N 2.95Å; D223-L226 PolarHBondContact O-N 2.81Å; M224-L226 VanDerWaalsContact C-N 3.3Å; M224-L226 PolarHBondContact O-N 3.27Å; L226-L228 PolarHBondContact O-N 2.97Å; L226-R229 PolarHBondContact O-N 3.32Å; L226-L230 HydrophobicContact CD1-CD1 4.19Å; L226-L230 HydrophobicContact CD1-CG 4.25Å; L226-L230 HydrophobicContact CG-CD1 4.12Å; L226-L230 WeakPolarHBondContact O-CG 3.04Å; L226-L230 PolarHBondContact O-N 2.95Å
227	A	94.4	Very high	93	Very high	6 Å²	6	90.2 Å²	90.2	5%	0.05	45%	0.452	C	S	.	.	H	α-helix	trans	-59.4	-47.1	177.8	0	0	0	0	0	112	L203 D206 D223 M224 R229 L230 R231	L203-A227 HydrophobicContact CD1-CB 4.02Å; D206-A227 HydrophobicContact CB-CB 3.87Å; D223-A227 PolarHBondContact O-N 3.39Å; M224-A227 PolarHBondContact O-N 2.98Å; A227-R229 PolarHBondContact O-N 2.71Å; A227-L230 PolarHBondContact O-N 3.06Å; A227-R231 WeakPolarHBondContact O-CB 3.44Å; A227-R231 PolarHBondContact O-N 3.41Å
228	L	95.7	Very high	93.2	Very high	27 Å²	27	89.4 Å²	89.4	14%	0.141	45%	0.451	C	S	.	.	H	α-helix	trans	-62.8	-40.4	177.6	-70.5	171.7	0	0	0	112.5	L203 M224 H225 L226 R231 G232 E233 L234	L203-L228 HydrophobicContact CD1-CD2 3.65Å; L203-L228 HydrophobicContact CD1-CG 3.87Å; L203-L228 HydrophobicContact CD2-CD2 4.06Å; M224-L228 HydrophobicContact CG-CD1 4.34Å; M224-L228 WeakPolarHBondContact O-CG 3.25Å; M224-L228 PolarHBondContact O-N 3.48Å; H225-L228 PolarHBondContact O-N 3.26Å; L226-L228 PolarHBondContact O-N 2.97Å; L228-R231 PolarHBondContact O-N 3.14Å; L228-G232 PolarHBondContact O-N 3.46Å; L228-G232 VanDerWaalsContact O-N 3.09Å; L228-E233 HydrophobicContact CD2-CB 4.27Å; L228-E233 WeakPolarHBondContact CD2-OE2 3.46Å; L228-E233 PolarHBondContact O-N 3.32Å; L228-E233 VanDerWaalsContact O-N 3.14Å; L228-L234 HydrophobicContact CB-CD1 3.5Å; L228-L234 VanDerWaalsContact CB-CD1 3.5Å; L228-L234 HydrophobicContact CB-CG 3.81Å; L228-L234 HydrophobicContact CD1-CD1 3.96Å; L228-L234 HydrophobicContact CD1-CG 4.33Å; L228-L234 HydrophobicContact CG-CD1 4.39Å
229	R	95.1	Very high	93.1	Very high	194 Å²	194	88.9 Å²	88.9	73%	0.732	44%	0.442	S	S	*	.	H	α-helix	trans	-65.8	-40	176.8	-174.8	172	-177.3	165.5	1.5	112.3	H225 L226 A227 R231 G232	H225-R229 VanDerWaalsContact O-CB 3.29Å; H225-R229 WeakPolarHBondContact O-CB 3.28Å; H225-R229 PolarHBondContact O-N 3.38Å; L226-R229 PolarHBondContact O-N 3.32Å; A227-R229 PolarHBondContact O-N 2.71Å; R229-R231 VanDerWaalsContact C-N 3.27Å; R229-R231 PolarHBondContact O-N 3.38Å; R229-G232 PolarHBondContact O-N 3.3Å
230	L	93.4	Very high	93	Very high	142 Å²	142	90.2 Å²	90.2	74%	0.743	45%	0.447	S	S	*	.	H	α-helix	trans	-69.2	-28.6	175.9	-70.3	174.7	0	0	0	112.3	L226 A227	L226-L230 HydrophobicContact CD1-CD1 4.19Å; L226-L230 HydrophobicContact CD1-CG 4.25Å; L226-L230 HydrophobicContact CG-CD1 4.12Å; L226-L230 WeakPolarHBondContact O-CG 3.04Å; L226-L230 PolarHBondContact O-N 2.95Å; A227-L230 PolarHBondContact O-N 3.06Å
231	R	93.4	Very high	92.8	Very high	116 Å²	116	92.1 Å²	92.1	44%	0.438	46%	0.457	S	S	.	.	H	α-helix	trans	-78.4	-20.1	176.6	-161.1	166.3	-174.1	-161.9	8.7	113.7	A227 L228 R229 E233	A227-R231 WeakPolarHBondContact O-CB 3.44Å; A227-R231 PolarHBondContact O-N 3.41Å; L228-R231 PolarHBondContact O-N 3.14Å; R229-R231 VanDerWaalsContact C-N 3.27Å; R229-R231 PolarHBondContact O-N 3.38Å; R231-E233 HydrophobicContact CB-CG 4.26Å; R231-E233 WeakPolarHBondContact CD-OE1 3.49Å; R231-E233 HydrophobicContact CG-CG 4.05Å; R231-E233 IonicContact CZ-OE1 3.8Å; R231-E233 IonicContact NE-OE1 3.15Å; R231-E233 PolarHBondContact NE-OE1 3.19Å; R231-E233 VanDerWaalsContact NE-OE1 3.08Å; R231-E233 IonicContact NH1-OE1 2.72Å; R231-E233 PolarHBondContact NH1-OE1 2.95Å; R231-E233 VanDerWaalsContact NH1-OE1 3.09Å; R231-E233 IonicContact NH1-OE2 3.31Å
232	G	92.4	Very high	92.5	Very high	61 Å²	61	91.8 Å²	91.8	63%	0.629	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	25.9	-177.1	0	0	0	0	0	113.9	L228 R229	L228-G232 PolarHBondContact O-N 3.46Å; L228-G232 VanDerWaalsContact O-N 3.09Å; R229-G232 PolarHBondContact O-N 3.3Å
233	E	85.5	Confident	92.3	Very high	84 Å²	84	87.3 Å²	87.3	39%	0.393	44%	0.435	S	S	.	.			trans	-95.6	-9.7	179.2	-65.2	178.3	175.9	0	0	113.2	Y199 L228 R231	Y199-E233 WeakPolarHBondContact CE2-OE1 3.5Å; Y199-E233 WeakPolarHBondContact CE2-OE2 3.25Å; Y199-E233 PolarHBondContact OH-OE2 3.38Å; L228-E233 HydrophobicContact CD2-CB 4.27Å; L228-E233 WeakPolarHBondContact CD2-OE2 3.46Å; L228-E233 PolarHBondContact O-N 3.32Å; L228-E233 VanDerWaalsContact O-N 3.14Å; R231-E233 HydrophobicContact CB-CG 4.26Å; R231-E233 WeakPolarHBondContact CD-OE1 3.49Å; R231-E233 HydrophobicContact CG-CG 4.05Å; R231-E233 IonicContact CZ-OE1 3.8Å; R231-E233 IonicContact NE-OE1 3.15Å; R231-E233 PolarHBondContact NE-OE1 3.19Å; R231-E233 VanDerWaalsContact NE-OE1 3.08Å; R231-E233 IonicContact NH1-OE1 2.72Å; R231-E233 PolarHBondContact NH1-OE1 2.95Å; R231-E233 VanDerWaalsContact NH1-OE1 3.09Å; R231-E233 IonicContact NH1-OE2 3.31Å
234	L	76.1	Confident	91.9	Very high	151 Å²	151	94.8 Å²	94.8	79%	0.791	47%	0.472	S	S	*	.			trans	-119.2	0	173.4	-71.7	173.7	0	0	0	109.5	L228	L228-L234 HydrophobicContact CB-CD1 3.5Å; L228-L234 VanDerWaalsContact CB-CD1 3.5Å; L228-L234 HydrophobicContact CB-CG 3.81Å; L228-L234 HydrophobicContact CD1-CD1 3.96Å; L228-L234 HydrophobicContact CD1-CG 4.33Å; L228-L234 HydrophobicContact CG-CD1 4.39Å

Retrieved 234 of 234 residues in 197.5 ms (Link to these results)

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