A0A087XHM9_POEFO Loading...

Aryl hydrocarbon receptor nuclear translocator

AlphaFold DB , UniProt , Accession A0A087XHM9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 796 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	31.8	Very low	27.8	Very low	229 Å²	229	143.2 Å²	143.2	100%	1.128	80%	0.799	S	S	*	*				0	101.8	0	-58.5	166.9	-171.2	0	0	104.6
2	L	27.4	Very low	27.9	Very low	158 Å²	158	145.9 Å²	145.9	83%	0.827	81%	0.81	S	S	*	*				64.4	118.7	70.6	-70.4	147	0	0	0	111.6
3	F	26.8	Very low	27.7	Very low	191 Å²	191	145.2 Å²	145.2	84%	0.838	80%	0.804	S	S	*	*			cis	-159.5	-179.4	-16.5	-145.6	-102.6	0	0	0	109.3
4	N	29.2	Very low	27.7	Very low	149 Å²	149	145.9 Å²	145.9	80%	0.797	80%	0.804	S	S	*	*			trans	-83.3	172.4	-178.8	-81.9	-1.1	0	0	0	114.9
5	A	31.7	Very low	27.6	Very low	81 Å²	81	141.9 Å²	141.9	67%	0.669	80%	0.798	S	S	*	*				115.3	128.8	129.2	0	0	0	0	0	119.7
6	D	26.5	Very low	27.6	Very low	148 Å²	148	141 Å²	141	79%	0.791	79%	0.791	S	S	*	*			trans	56.9	144.5	134.5	-59.5	-41	0	0	0	122.6
7	M	26.2	Very low	27.7	Very low	168 Å²	168	142.2 Å²	142.2	83%	0.828	79%	0.788	S	S	*	*			cis	89.6	146.1	39.1	-99.6	-72.2	-165.4	0	0	115.2
8	S	25.4	Very low	27.5	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	78%	0.781	S	S	*	*			trans	68.9	128.5	-171.1	76.6	0	0	0	0	113.2
9	S	26.5	Very low	27.6	Very low	110 Å²	110	141.3 Å²	141.3	77%	0.769	79%	0.787	S	S	*	*				64.5	137.2	58.6	90.7	0	0	0	0	112.7
10	S	28.5	Very low	27.5	Very low	95 Å²	95	137.4 Å²	137.4	66%	0.664	78%	0.78	S	S	*	*			cis	-166.3	178.9	27.9	55.6	0	0	0	0	112.4
11	N	26.1	Very low	27.6	Very low	145 Å²	145	140.7 Å²	140.7	78%	0.775	79%	0.792	S	S	*	*			trans	48.2	129.4	154.7	-70.6	-15.6	0	0	0	121.5
12	L	29.2	Very low	27.4	Very low	176 Å²	176	133.1 Å²	133.1	92%	0.921	77%	0.772	S	S	*	*				-165	168.7	101.1	-105.7	164.3	0	0	0	112.1
13	D	25	Very low	27.5	Very low	137 Å²	137	130.1 Å²	130.1	73%	0.733	77%	0.771	S	S	*	*			trans	-123.6	175.3	-167.1	-156.7	-14.9	0	0	0	111.2
14	L	27.1	Very low	27.7	Very low	154 Å²	154	127 Å²	127	81%	0.806	77%	0.773	S	S	*	*			trans	80.4	129.6	158.8	-70.1	162.7	0	0	0	122.3
15	A	26.5	Very low	27.7	Very low	87 Å²	87	123.1 Å²	123.1	72%	0.719	77%	0.768	S	S	*	*			trans	77.4	84.7	134	0	0	0	0	0	122
16	D	27.1	Very low	27.7	Very low	127 Å²	127	125.8 Å²	125.8	68%	0.679	78%	0.776	S	S	*	*				29.1	125.1	109.5	-170	28.1	0	0	0	120.2
17	H	29	Very low	28	Very low	162 Å²	162	126.6 Å²	126.6	75%	0.75	78%	0.775	S	S	*	*				-173	120.2	115.9	-102.9	-10.1	0	0	0	118.7
18	S	25.3	Very low	28.1	Very low	93 Å²	93	126.4 Å²	126.4	65%	0.65	78%	0.777	S	S	*	*			trans	80.2	175.2	131.4	85.4	0	0	0	0	121.9
19	L	29.5	Very low	28.4	Very low	173 Å²	173	125 Å²	125	91%	0.906	78%	0.778	S	S	*	*			trans	72.7	132.2	-175	-49.7	178.9	0	0	0	115.6
20	G	24.4	Very low	28.6	Very low	63 Å²	63	123.5 Å²	123.5	65%	0.649	78%	0.781	S	S	*	*			cis	162.8	151.4	-8.5	0	0	0	0	0	112.5
21	M	30.8	Very low	28.7	Very low	207 Å²	207	124.3 Å²	124.3	100%	1.02	79%	0.793	S	S	*	*			trans	66.8	152.6	178.9	-49.6	175.1	176.8	0	0	115.4
22	G	27.8	Very low	28.9	Very low	70 Å²	70	121.5 Å²	121.5	72%	0.722	80%	0.798	S	S	*	*			cis	178	153.7	-12.4	0	0	0	0	0	115.2
23	A	29.8	Very low	29	Very low	96 Å²	96	116.6 Å²	116.6	79%	0.793	79%	0.791	S	S	*	*			trans	68.1	134.4	151.3	0	0	0	0	0	123.1
24	S	29.7	Very low	30.2	Very low	126 Å²	126	115.6 Å²	115.6	88%	0.881	79%	0.791	S	S	*	*			trans	65.1	137.7	150.8	-55.4	0	0	0	0	120.3
25	G	28.8	Very low	30.6	Very low	67 Å²	67	118.1 Å²	118.1	69%	0.691	80%	0.796	S	S	*	*			cis	137.3	110.3	-15.5	0	0	0	0	0	115.6
26	T	31.7	Very low	30.8	Very low	136 Å²	136	116.8 Å²	116.8	83%	0.834	79%	0.791	S	S	*	*			trans	170.1	157.7	148.1	25.6	0	0	0	0	107.4
27	Q	33.6	Very low	31.2	Very low	165 Å²	165	117.6 Å²	117.6	77%	0.771	80%	0.801	S	S	*	*			cis	171.5	114	-34.8	-110.3	-174.7	13.6	0	0	105.6
28	N	28.5	Very low	31.3	Very low	164 Å²	164	116.7 Å²	116.7	88%	0.877	80%	0.801	S	S	*	*			trans	163	144.1	136.6	-86.8	-16.5	0	0	0	111.7
29	G	30.6	Very low	31.7	Very low	71 Å²	71	120.4 Å²	120.4	73%	0.732	81%	0.806	S	S	*	*			cis	170.6	105.1	-8.7	0	0	0	0	0	115.1
30	G	30.9	Very low	31.9	Very low	80 Å²	80	122.8 Å²	122.8	83%	0.825	80%	0.803	S	S	*	*			trans	79	166.4	161.9	0	0	0	0	0	117.6
31	A	31.5	Very low	32.4	Very low	111 Å²	111	130.2 Å²	130.2	92%	0.917	81%	0.811	S	S	*	*			cis	-165.5	148.6	-18.5	0	0	0	0	0	110.8
32	G	30.1	Very low	32.3	Very low	86 Å²	86	124.5 Å²	124.5	89%	0.887	80%	0.797	S	S	*	*			trans	144.1	120.5	166.9	0	0	0	0	0	115.9
33	G	30.8	Very low	32.6	Very low	74 Å²	74	125.8 Å²	125.8	76%	0.763	80%	0.8	S	S	*	*			trans	-137.3	-147.7	166.4	0	0	0	0	0	109.3
34	P	51.2	Low	33.4	Very low	115 Å²	115	126.9 Å²	126.9	75%	0.747	80%	0.8	S	S	*	*			cis	-142.3	-167.8	-5.9	36	-13.5	0	0	0	114.8
35	K	34.2	Very low	33.9	Very low	207 Å²	207	128 Å²	128	90%	0.9	80%	0.796	S	S	*	*			trans	82.4	137.2	165.9	-54.5	172.5	-178.6	177.6	0	117.5
36	G	31.2	Very low	34.1	Very low	60 Å²	60	134.2 Å²	134.2	62%	0.619	80%	0.804	S	S	*	*			cis	168.1	170.8	-11.6	0	0	0	0	0	116.3
37	T	34.9	Very low	34.3	Very low	143 Å²	143	133.6 Å²	133.6	88%	0.877	80%	0.796	S	S	*	*			trans	70.7	143.2	169.7	72.5	0	0	0	0	117
38	N	32.8	Very low	34.6	Very low	143 Å²	143	133 Å²	133	77%	0.765	80%	0.797	S	S	*	*			cis	-149.7	176.7	-5	-144.4	-14.7	0	0	0	113.7
39	K	33.3	Very low	35.1	Very low	172 Å²	172	132.8 Å²	132.8	75%	0.748	80%	0.796	S	S	*	*			trans	-33	142.6	176.7	-72.9	169.8	-178.6	177.8	0	117.4
40	R	32.9	Very low	35.6	Very low	222 Å²	222	137.1 Å²	137.1	84%	0.838	80%	0.803	S	S	*	*				62.1	141	67.7	-66.2	-175.2	178.9	-175.4	0.5	113.3
41	R	34.9	Very low	35.9	Very low	220 Å²	220	140 Å²	140	83%	0.83	80%	0.799	S	S	*	*			cis	-163.6	144.7	12.4	-139.2	-175.8	-177.1	-176.7	-2.6	113.2
42	A	28.9	Very low	36	Very low	86 Å²	86	137.3 Å²	137.3	71%	0.711	78%	0.783	S	S	*	*			trans	27.6	140.5	140.8	0	0	0	0	0	126.3
43	A	35.4	Very low	36.7	Very low	97 Å²	97	138.4 Å²	138.4	80%	0.802	78%	0.777	S	S	*	*			trans	68.1	160.3	140	0	0	0	0	0	119.6
44	P	45	Very low	37.2	Very low	120 Å²	120	144.7 Å²	144.7	78%	0.779	78%	0.783	S	S	*	*			cis	-131.7	-168.9	10.6	44.4	-27.3	0	0	0	116.2
45	D	40.4	Very low	36.4	Very low	150 Å²	150	148 Å²	148	80%	0.802	79%	0.791	S	S	*	*			trans	-73.7	162.9	169.1	-47.8	-82.5	0	0	0	114.1
46	F	32.9	Very low	36.8	Very low	197 Å²	197	146.2 Å²	146.2	86%	0.864	79%	0.79	S	S	*	*			trans	-166.4	166.6	146	-118.4	-78	0	0	0	111.1
47	D	36.5	Very low	37.2	Very low	123 Å²	123	155.3 Å²	155.3	66%	0.658	81%	0.806	S	S	*	*			trans	-92.6	-179	-153	-46.1	-86	0	0	0	119.2
48	D	39.1	Very low	37.9	Very low	151 Å²	151	157.9 Å²	157.9	81%	0.807	81%	0.805	S	S	*	*			trans	78.7	127.9	150	-66.4	-12.5	0	0	0	125
49	D	40.3	Very low	38.4	Very low	160 Å²	160	158.6 Å²	158.6	86%	0.856	81%	0.809	S	S	*	*			trans	-6.3	146.2	150.2	-59.7	-22.8	0	0	0	122.8
50	D	39.8	Very low	39	Very low	163 Å²	163	155.7 Å²	155.7	87%	0.872	80%	0.802	S	S	*	*				-160.5	164.9	121.9	-161.3	16.9	0	0	0	112.8
51	D	38.6	Very low	39.4	Very low	140 Å²	140	153.7 Å²	153.7	75%	0.749	80%	0.802	S	S	*	*			trans	-68.1	174.5	177.8	175.1	43.8	0	0	0	114.5
52	G	32.3	Very low	40.2	Very low	55 Å²	55	149 Å²	149	57%	0.567	80%	0.798	S	S	*	*			trans	159.3	59.7	153.8	0	0	0	0	0	118.5	K54	G52-K54 PolarHBondContact O-N 2.98Å
53	S	44.5	Very low	41.2	Very low	109 Å²	109	148.3 Å²	148.3	76%	0.762	80%	0.799	S	S	*	*			trans	-40.1	133.7	169.9	-71.5	0	0	0	0	115.1
54	K	42	Very low	41.9	Very low	206 Å²	206	145.2 Å²	145.2	90%	0.896	78%	0.777	S	S	*	*			trans	-145.2	139.8	156.5	-107.3	111.2	-165.5	168.1	0	113.7	G52	G52-K54 PolarHBondContact O-N 2.98Å
55	M	34.3	Very low	42.5	Very low	184 Å²	184	142.9 Å²	142.9	91%	0.906	76%	0.763	S	S	*	*			trans	-70.9	157.9	179.8	-64.1	173.5	175.2	0	0	113
56	L	43.4	Very low	43.2	Very low	170 Å²	170	142.2 Å²	142.2	89%	0.89	76%	0.759	S	S	*	*			trans	-52.3	140.7	158.6	-64.1	165.3	0	0	0	110.9
57	R	38.6	Very low	44.5	Very low	251 Å²	251	138.5 Å²	138.5	95%	0.947	75%	0.749	S	S	*	*			trans	-123.5	146.3	154.5	-83.1	-169.4	170.9	-164.7	-2.8	108.6
58	F	50.5	Low	45.7	Very low	196 Å²	196	138.6 Å²	138.6	86%	0.86	75%	0.745	S	S	*	*			trans	-134.4	122.2	-173.4	-155.4	-74.4	0	0	0	108.4
59	D	42.2	Very low	46.8	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	74%	0.737	S	S	*	*			trans	179.3	94.4	167.9	-92.8	-28.3	0	0	0	102.8
60	D	46.2	Very low	47.9	Very low	111 Å²	111	135.4 Å²	135.4	59%	0.594	72%	0.718	S	S	*	*				70.9	121.9	79.1	-164.7	20.7	0	0	0	114.2	T62	D60-T62 PolarHBondContact OD1-N 2.74Å; D60-T62 PolarHBondContact OD1-OG1 3.32Å; D60-T62 VanDerWaalsContact OD1-OG1 3.08Å
61	E	41.7	Very low	49.2	Very low	180 Å²	180	134.9 Å²	134.9	84%	0.841	70%	0.704	S	S	*	*			trans	-163.1	71	146.7	-111.3	-67.2	99.9	0	0	107.3	G63	E61-G63 PolarHBondContact O-N 2.69Å; E61-G63 VanDerWaalsContact O-N 3.16Å
62	T	51.7	Low	50.3	Low	122 Å²	122	135.2 Å²	135.2	75%	0.748	70%	0.699	S	S	*	*			trans	-5.2	98	160.3	-68.9	0	0	0	0	116.3	D60	D60-T62 PolarHBondContact OD1-N 2.74Å; D60-T62 PolarHBondContact OD1-OG1 3.32Å; D60-T62 VanDerWaalsContact OD1-OG1 3.08Å
63	G	48.7	Very low	52	Low	70 Å²	70	135.5 Å²	135.5	72%	0.722	70%	0.696	S	S	*	*			trans	-166.8	-30.7	173.3	0	0	0	0	0	117.5	E61	E61-G63 PolarHBondContact O-N 2.69Å; E61-G63 VanDerWaalsContact O-N 3.16Å
64	G	50.3	Low	53.2	Low	33 Å²	33	137 Å²	137	34%	0.34	69%	0.685	S	S	.	*			trans	-76.1	-25.8	-172	0	0	0	0	0	116.8	N66 N67 E68	G64-N66 PolarHBondContact O-N 2.68Å; G64-N67 PolarHBondContact O-N 2.84Å; G64-E68 VanDerWaalsContact C-OE2 3.3Å; G64-E68 PolarHBondContact O-N 2.9Å
65	S	58.7	Low	54.7	Low	71 Å²	71	131.6 Å²	131.6	50%	0.497	66%	0.663	S	S	.	*	H	α-helix	trans	-57.8	-34.7	-153.7	-164.7	0	0	0	0	116.3	E68 K69	S65-E68 PolarHBondContact N-OE2 3.14Å; S65-K69 WeakPolarHBondContact O-CB 3.49Å; S65-K69 PolarHBondContact O-N 2.85Å
66	N	55.8	Low	56.9	Low	135 Å²	135	126.9 Å²	126.9	72%	0.722	64%	0.641	S	S	*	*	H	α-helix	trans	-71.3	-44.1	177.1	-80	-23.6	0	0	0	112.3	G64 E68 K69 E70	G64-N66 PolarHBondContact O-N 2.68Å; N66-E68 VanDerWaalsContact C-N 3.28Å; N66-E68 PolarHBondContact O-N 3.22Å; N66-K69 PolarHBondContact O-N 3.22Å; N66-E70 WeakPolarHBondContact O-CB 3.41Å; N66-E70 PolarHBondContact O-N 3.2Å
67	N	59.3	Low	58.7	Low	120 Å²	120	125 Å²	125	64%	0.642	63%	0.628	S	S	*	*	H	α-helix	trans	-65.5	-35.3	175.3	-74.7	-26.7	0	0	0	111	G64 R71	G64-N67 PolarHBondContact O-N 2.84Å; N67-R71 WeakPolarHBondContact O-CB 3.36Å; N67-R71 PolarHBondContact O-N 3.04Å
68	E	60.8	Low	61	Low	125 Å²	125	116.1 Å²	116.1	58%	0.584	60%	0.604	S	S	*	*	H	α-helix	trans	-70.9	-42.3	177.2	-69	172.6	133.3	0	0	112.4	G64 S65 N66 R71 F72	G64-E68 VanDerWaalsContact C-OE2 3.3Å; G64-E68 PolarHBondContact O-N 2.9Å; S65-E68 PolarHBondContact N-OE2 3.14Å; N66-E68 VanDerWaalsContact C-N 3.28Å; N66-E68 PolarHBondContact O-N 3.22Å; E68-R71 PolarHBondContact O-N 2.7Å; E68-F72 VanDerWaalsContact O-CB 3.25Å; E68-F72 WeakPolarHBondContact O-CB 3.15Å; E68-F72 PolarHBondContact O-N 3.23Å
69	K	62.8	Low	62.8	Low	148 Å²	148	109.9 Å²	109.9	64%	0.643	58%	0.578	S	S	*	*	H	α-helix	trans	-61.2	-43.8	170.9	-85.9	-179.6	174.2	173.3	0	112.1	S65 N66 F72 A73	S65-K69 WeakPolarHBondContact O-CB 3.49Å; S65-K69 PolarHBondContact O-N 2.85Å; N66-K69 PolarHBondContact O-N 3.22Å; K69-F72 PolarHBondContact O-N 3Å; K69-A73 WeakPolarHBondContact O-CB 3.32Å; K69-A73 PolarHBondContact O-N 2.92Å
70	E	63.4	Low	65	Low	96 Å²	96	106.6 Å²	106.6	45%	0.449	56%	0.559	S	S	.	*	H	α-helix	trans	-69	-36.3	179.3	-148.3	-167.2	-166.4	0	0	111.7	N66 R74	N66-E70 WeakPolarHBondContact O-CB 3.41Å; N66-E70 PolarHBondContact O-N 3.2Å; E70-R74 WeakPolarHBondContact O-CB 3.02Å; E70-R74 VanDerWaalsContact O-CG 3.28Å; E70-R74 WeakPolarHBondContact O-CG 3.32Å; E70-R74 PolarHBondContact O-N 3.48Å; E70-R74 IonicContact OE1-CZ 2.7Å; E70-R74 IonicContact OE1-NH1 2.76Å; E70-R74 IonicContact OE1-NH2 3.91Å; E70-R74 PolarHBondContact OE1-NH2 3.15Å; E70-R74 IonicContact OE2-CZ 2.76Å; E70-R74 VanDerWaalsContact OE2-CZ 3.29Å; E70-R74 IonicContact OE2-NH1 2.66Å; E70-R74 PolarHBondContact OE2-NH1 2.98Å; E70-R74 IonicContact OE2-NH2 2.68Å; E70-R74 PolarHBondContact OE2-NH2 2.94Å; E70-R74 VanDerWaalsContact OE2-NH2 3.13Å
71	R	66.7	Low	67.3	Low	152 Å²	152	104 Å²	104	57%	0.574	54%	0.543	S	S	*	.	H	α-helix	trans	-63.8	-46.9	171	-175.3	-175.7	179.4	-66.3	-6.6	111.2	N67 E68 R74 E75	N67-R71 WeakPolarHBondContact O-CB 3.36Å; N67-R71 PolarHBondContact O-N 3.04Å; E68-R71 PolarHBondContact O-N 2.7Å; R71-R74 PolarHBondContact O-N 3.32Å; R71-E75 IonicContact CZ-OE2 3.13Å; R71-E75 IonicContact NH1-OE2 3.65Å; R71-E75 PolarHBondContact NH1-OE2 3.02Å; R71-E75 IonicContact NH2-OE2 2.67Å; R71-E75 WeakPolarHBondContact O-CB 3.39Å; R71-E75 PolarHBondContact O-N 3.22Å
72	F	62.5	Low	69.7	Low	146 Å²	146	101.6 Å²	101.6	64%	0.64	53%	0.527	S	S	*	.	H	α-helix	trans	-66	-39	179.6	-169	-97.6	0	0	0	112.1	E68 K69 E75 N76	E68-F72 VanDerWaalsContact O-CB 3.25Å; E68-F72 WeakPolarHBondContact O-CB 3.15Å; E68-F72 PolarHBondContact O-N 3.23Å; K69-F72 PolarHBondContact O-N 3Å; F72-E75 PolarHBondContact O-N 3Å; F72-N76 VanDerWaalsContact O-CB 3.3Å; F72-N76 WeakPolarHBondContact O-CB 3.46Å; F72-N76 PolarHBondContact O-N 3.29Å
73	A	67.8	Low	71.7	Confident	61 Å²	61	103 Å²	103	50%	0.504	52%	0.518	S	S	.	.	H	α-helix	trans	-64.1	-44.3	172.7	0	0	0	0	0	112.1	K69 E75 H77	K69-A73 WeakPolarHBondContact O-CB 3.32Å; K69-A73 PolarHBondContact O-N 2.92Å; A73-E75 VanDerWaalsContact C-N 3.34Å; A73-H77 WeakPolarHBondContact O-CB 3.37Å; A73-H77 PolarHBondContact O-N 2.61Å
74	R	70.8	Confident	73.9	Confident	140 Å²	140	106.8 Å²	106.8	53%	0.528	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-35.7	173.3	-74.8	178.4	-177.5	118.7	7.4	112.6	E70 R71 S78	E70-R74 WeakPolarHBondContact O-CB 3.02Å; E70-R74 VanDerWaalsContact O-CG 3.28Å; E70-R74 WeakPolarHBondContact O-CG 3.32Å; E70-R74 PolarHBondContact O-N 3.48Å; E70-R74 IonicContact OE1-CZ 2.7Å; E70-R74 IonicContact OE1-NH1 2.76Å; E70-R74 IonicContact OE1-NH2 3.91Å; E70-R74 PolarHBondContact OE1-NH2 3.15Å; E70-R74 IonicContact OE2-CZ 2.76Å; E70-R74 VanDerWaalsContact OE2-CZ 3.29Å; E70-R74 IonicContact OE2-NH1 2.66Å; E70-R74 PolarHBondContact OE2-NH1 2.98Å; E70-R74 IonicContact OE2-NH2 2.68Å; E70-R74 PolarHBondContact OE2-NH2 2.94Å; E70-R74 VanDerWaalsContact OE2-NH2 3.13Å; R71-R74 PolarHBondContact O-N 3.32Å; R74-S78 WeakPolarHBondContact O-CB 3.32Å; R74-S78 PolarHBondContact O-N 3.34Å; R74-S78 PolarHBondContact O-OG 3.2Å
75	E	72.9	Confident	76	Confident	93 Å²	93	110.8 Å²	110.8	44%	0.435	52%	0.516	S	S	.	.	H	α-helix	trans	-70.4	-45.3	178.6	-175.8	150.2	-141.9	0	0	111	R71 F72 A73 S78 E79	R71-E75 IonicContact CZ-OE2 3.13Å; R71-E75 IonicContact NH1-OE2 3.65Å; R71-E75 PolarHBondContact NH1-OE2 3.02Å; R71-E75 IonicContact NH2-OE2 2.67Å; R71-E75 WeakPolarHBondContact O-CB 3.39Å; R71-E75 PolarHBondContact O-N 3.22Å; F72-E75 PolarHBondContact O-N 3Å; A73-E75 VanDerWaalsContact C-N 3.34Å; E75-S78 CarbonylContact O-C 3.59Å; E75-S78 WeakPolarHBondContact O-CB 3.44Å; E75-S78 PolarHBondContact O-N 3.28Å; E75-E79 WeakPolarHBondContact O-CB 3.37Å; E75-E79 PolarHBondContact O-N 3.28Å
76	N	79.4	Confident	77.7	Confident	86 Å²	86	112.3 Å²	112.3	46%	0.46	52%	0.518	S	S	.	.	H	α-helix	trans	-58.6	-47.8	171.9	-174.3	-84.3	0	0	0	111.8	F72 S78 E79 I80	F72-N76 VanDerWaalsContact O-CB 3.3Å; F72-N76 WeakPolarHBondContact O-CB 3.46Å; F72-N76 PolarHBondContact O-N 3.29Å; N76-S78 PolarHBondContact O-N 2.84Å; N76-E79 PolarHBondContact O-N 2.79Å; N76-I80 WeakPolarHBondContact O-CG1 3.43Å; N76-I80 PolarHBondContact O-N 2.87Å; N76-I80 WeakPolarHBondContact OD1-CD1 3.33Å
77	H	82.3	Confident	79.6	Confident	131 Å²	131	111.9 Å²	111.9	61%	0.606	51%	0.51	S	S	*	.	H	α-helix	trans	-61.7	-42	174.8	-175.5	77.4	0	0	0	112.5	A73 E79 I80 E81	A73-H77 WeakPolarHBondContact O-CB 3.37Å; A73-H77 PolarHBondContact O-N 2.61Å; H77-E79 VanDerWaalsContact C-N 3.27Å; H77-E79 PolarHBondContact O-N 3.2Å; H77-I80 PolarHBondContact O-N 3.04Å; H77-E81 WeakPolarHBondContact O-CB 3.46Å; H77-E81 PolarHBondContact O-N 2.77Å
78	S	87.3	Confident	81.3	Confident	64 Å²	64	110.6 Å²	110.6	45%	0.448	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-32.2	175.6	-63.2	0	0	0	0	112.4	R74 E75 N76 R82	R74-S78 WeakPolarHBondContact O-CB 3.32Å; R74-S78 PolarHBondContact O-N 3.34Å; R74-S78 PolarHBondContact O-OG 3.2Å; E75-S78 CarbonylContact O-C 3.59Å; E75-S78 WeakPolarHBondContact O-CB 3.44Å; E75-S78 PolarHBondContact O-N 3.28Å; N76-S78 PolarHBondContact O-N 2.84Å; S78-R82 WeakPolarHBondContact O-CB 3.42Å; S78-R82 PolarHBondContact O-N 2.78Å
79	E	88.4	Confident	82.9	Confident	65 Å²	65	107 Å²	107	30%	0.304	49%	0.49	S	S	.	.	H	α-helix	trans	-76.8	-39.4	175.6	-144.9	-150	143.5	0	0	112.4	E75 N76 H77 E81 R82 R83	E75-E79 WeakPolarHBondContact O-CB 3.37Å; E75-E79 PolarHBondContact O-N 3.28Å; N76-E79 PolarHBondContact O-N 2.79Å; H77-E79 VanDerWaalsContact C-N 3.27Å; H77-E79 PolarHBondContact O-N 3.2Å; E79-E81 VanDerWaalsContact C-N 3.27Å; E79-E81 PolarHBondContact O-N 3.3Å; E79-R82 CarbonylContact O-C 3.58Å; E79-R82 WeakPolarHBondContact O-CA 3.45Å; E79-R82 WeakPolarHBondContact O-CB 3.28Å; E79-R82 PolarHBondContact O-N 2.98Å; E79-R82 VanDerWaalsContact O-N 3.11Å; E79-R83 WeakPolarHBondContact O-CB 3.27Å; E79-R83 VanDerWaalsContact O-CG 3.28Å; E79-R83 WeakPolarHBondContact O-CG 3.38Å; E79-R83 PolarHBondContact O-N 3.2Å; E79-R83 IonicContact OE1-CZ 3.97Å; E79-R83 IonicContact OE1-NE 3.18Å; E79-R83 PolarHBondContact OE1-NE 2.84Å; E79-R83 IonicContact OE1-NH2 3.29Å; E79-R83 PolarHBondContact OE1-NH2 3.43Å; E79-R83 IonicContact OE2-CZ 2.81Å; E79-R83 IonicContact OE2-NE 3.32Å; E79-R83 IonicContact OE2-NH2 2.79Å; E79-R83 PolarHBondContact OE2-NH2 3.18Å
80	I	88.4	Confident	84.5	Confident	90 Å²	90	102.1 Å²	102.1	46%	0.462	48%	0.477	S	S	.	.	H	α-helix	trans	-56.1	-46.2	169.9	-70.4	165.8	0	0	0	109.7	N76 H77 R82 R83 R84	N76-I80 WeakPolarHBondContact O-CG1 3.43Å; N76-I80 PolarHBondContact O-N 2.87Å; N76-I80 WeakPolarHBondContact OD1-CD1 3.33Å; H77-I80 PolarHBondContact O-N 3.04Å; I80-R82 VanDerWaalsContact C-N 3.35Å; I80-R82 PolarHBondContact O-N 2.85Å; I80-R83 PolarHBondContact O-N 2.72Å; I80-R84 WeakPolarHBondContact O-CB 3.38Å; I80-R84 PolarHBondContact O-N 3.14Å
81	E	93.4	Very high	86.1	Confident	56 Å²	56	103.4 Å²	103.4	26%	0.262	48%	0.479	S	S	.	.	H	α-helix	trans	-69.6	-29.2	177	176.9	46.2	-150.8	0	0	112.9	H77 E79 R84 R85	H77-E81 WeakPolarHBondContact O-CB 3.46Å; H77-E81 PolarHBondContact O-N 2.77Å; E79-E81 VanDerWaalsContact C-N 3.27Å; E79-E81 PolarHBondContact O-N 3.3Å; E81-R84 VanDerWaalsContact CD-NH1 3.27Å; E81-R84 IonicContact OE1-NH1 2.72Å; E81-R84 PolarHBondContact OE1-NH1 3.24Å; E81-R84 VanDerWaalsContact OE1-NH1 3.1Å; E81-R84 WeakPolarHBondContact OE2-CD 3.48Å; E81-R84 IonicContact OE2-CZ 2.71Å; E81-R84 IonicContact OE2-NE 3.88Å; E81-R84 IonicContact OE2-NH1 2.71Å; E81-R84 PolarHBondContact OE2-NH1 3.44Å; E81-R85 WeakPolarHBondContact O-CB 3.46Å; E81-R85 WeakPolarHBondContact O-CG 3.25Å; E81-R85 PolarHBondContact O-N 3.35Å; E81-R85 PolarHBondContact O-NE 3.17Å; E81-R85 VanDerWaalsContact O-NE 3.1Å; E81-R85 VanDerWaalsContact OE1-CD 3.26Å; E81-R85 WeakPolarHBondContact OE1-CD 3.47Å; E81-R85 VanDerWaalsContact OE1-CG 3.28Å; E81-R85 WeakPolarHBondContact OE1-CG 3.24Å; E81-R85 IonicContact OE1-NE 2.72Å; E81-R85 PolarHBondContact OE1-NE 3.4Å
82	R	92.2	Very high	87.4	Confident	130 Å²	130	96.8 Å²	96.8	49%	0.491	46%	0.455	S	S	.	.	H	α-helix	trans	-66	-49.1	169.6	-173	-168	-64.7	151.1	-1	110.8	S78 E79 I80 R84 R85 N86	S78-R82 WeakPolarHBondContact O-CB 3.42Å; S78-R82 PolarHBondContact O-N 2.78Å; E79-R82 CarbonylContact O-C 3.58Å; E79-R82 WeakPolarHBondContact O-CA 3.45Å; E79-R82 WeakPolarHBondContact O-CB 3.28Å; E79-R82 PolarHBondContact O-N 2.98Å; E79-R82 VanDerWaalsContact O-N 3.11Å; I80-R82 VanDerWaalsContact C-N 3.35Å; I80-R82 PolarHBondContact O-N 2.85Å; R82-R84 VanDerWaalsContact C-N 3.33Å; R82-R84 PolarHBondContact O-N 2.88Å; R82-R85 PolarHBondContact O-N 2.86Å; R82-N86 VanDerWaalsContact O-CG 3.28Å; R82-N86 PolarHBondContact O-N 3.18Å; R82-N86 PolarHBondContact O-OD1 3.47Å
83	R	93.1	Very high	88.9	Confident	151 Å²	151	90.9 Å²	90.9	57%	0.57	44%	0.435	S	S	*	.	H	α-helix	trans	-60.4	-42.1	177.3	-67.8	170.4	-171.7	-175.3	4.7	110.7	E79 I80 N86 K87	E79-R83 WeakPolarHBondContact O-CB 3.27Å; E79-R83 VanDerWaalsContact O-CG 3.28Å; E79-R83 WeakPolarHBondContact O-CG 3.38Å; E79-R83 PolarHBondContact O-N 3.2Å; E79-R83 IonicContact OE1-CZ 3.97Å; E79-R83 IonicContact OE1-NE 3.18Å; E79-R83 PolarHBondContact OE1-NE 2.84Å; E79-R83 IonicContact OE1-NH2 3.29Å; E79-R83 PolarHBondContact OE1-NH2 3.43Å; E79-R83 IonicContact OE2-CZ 2.81Å; E79-R83 IonicContact OE2-NE 3.32Å; E79-R83 IonicContact OE2-NH2 2.79Å; E79-R83 PolarHBondContact OE2-NH2 3.18Å; I80-R83 PolarHBondContact O-N 2.72Å; R83-N86 PolarHBondContact O-N 2.84Å; R83-K87 WeakPolarHBondContact O-CB 3.12Å; R83-K87 PolarHBondContact O-N 3.14Å
84	R	95.1	Very high	90.3	Very high	149 Å²	149	92.9 Å²	92.9	56%	0.562	43%	0.434	S	S	*	.	H	α-helix	trans	-59.9	-48.1	172.6	177.3	173.5	163.4	-80.6	-3	112.5	I80 E81 R82 N86 K87 M88	I80-R84 WeakPolarHBondContact O-CB 3.38Å; I80-R84 PolarHBondContact O-N 3.14Å; E81-R84 VanDerWaalsContact CD-NH1 3.27Å; E81-R84 IonicContact OE1-NH1 2.72Å; E81-R84 PolarHBondContact OE1-NH1 3.24Å; E81-R84 VanDerWaalsContact OE1-NH1 3.1Å; E81-R84 WeakPolarHBondContact OE2-CD 3.48Å; E81-R84 IonicContact OE2-CZ 2.71Å; E81-R84 IonicContact OE2-NE 3.88Å; E81-R84 IonicContact OE2-NH1 2.71Å; E81-R84 PolarHBondContact OE2-NH1 3.44Å; R82-R84 VanDerWaalsContact C-N 3.33Å; R82-R84 PolarHBondContact O-N 2.88Å; R84-N86 VanDerWaalsContact C-N 3.35Å; R84-N86 PolarHBondContact O-N 3.15Å; R84-K87 PolarHBondContact O-N 2.93Å; R84-M88 WeakPolarHBondContact O-CB 3.37Å; R84-M88 PolarHBondContact O-N 2.83Å
85	R	94.9	Very high	91.4	Very high	118 Å²	118	88.5 Å²	88.5	45%	0.445	42%	0.42	S	S	.	.	H	α-helix	trans	-64.7	-35.3	176.2	-82.8	175.9	-74.3	134.6	-2.5	113.3	E81 R82 S89	E81-R85 WeakPolarHBondContact O-CB 3.46Å; E81-R85 WeakPolarHBondContact O-CG 3.25Å; E81-R85 PolarHBondContact O-N 3.35Å; E81-R85 PolarHBondContact O-NE 3.17Å; E81-R85 VanDerWaalsContact O-NE 3.1Å; E81-R85 VanDerWaalsContact OE1-CD 3.26Å; E81-R85 WeakPolarHBondContact OE1-CD 3.47Å; E81-R85 VanDerWaalsContact OE1-CG 3.28Å; E81-R85 WeakPolarHBondContact OE1-CG 3.24Å; E81-R85 IonicContact OE1-NE 2.72Å; E81-R85 PolarHBondContact OE1-NE 3.4Å; R82-R85 PolarHBondContact O-N 2.86Å; R85-S89 WeakPolarHBondContact O-CB 3.27Å; R85-S89 PolarHBondContact O-N 3.29Å; R85-S89 PolarHBondContact O-OG 3.08Å
86	N	95.2	Very high	92.4	Very high	103 Å²	103	84.1 Å²	84.1	55%	0.551	40%	0.4	S	S	*	.	H	α-helix	trans	-66.5	-48.6	174.4	-70.4	3.8	0	0	0	110.5	R82 R83 R84 M88 S89 A90	R82-N86 VanDerWaalsContact O-CG 3.28Å; R82-N86 PolarHBondContact O-N 3.18Å; R82-N86 PolarHBondContact O-OD1 3.47Å; R83-N86 PolarHBondContact O-N 2.84Å; R84-N86 VanDerWaalsContact C-N 3.35Å; R84-N86 PolarHBondContact O-N 3.15Å; N86-M88 PolarHBondContact O-N 3.14Å; N86-S89 WeakPolarHBondContact O-CA 3.5Å; N86-S89 WeakPolarHBondContact O-CB 3.31Å; N86-S89 PolarHBondContact O-N 3.48Å; N86-A90 PolarHBondContact O-N 2.95Å
87	K	95.6	Very high	93.1	Very high	125 Å²	125	84 Å²	84	54%	0.543	40%	0.399	S	S	.	.	H	α-helix	trans	-60.6	-43.1	176.8	-157.4	-176.2	-164.4	-164.3	0	112.5	R83 R84 S89 A90 Y91	R83-K87 WeakPolarHBondContact O-CB 3.12Å; R83-K87 PolarHBondContact O-N 3.14Å; R84-K87 PolarHBondContact O-N 2.93Å; K87-S89 VanDerWaalsContact C-N 3.26Å; K87-S89 PolarHBondContact O-N 3.45Å; K87-A90 PolarHBondContact O-N 2.95Å; K87-Y91 HydrophobicContact CD-CE2 4.07Å; K87-Y91 WeakPolarHBondContact CE-OH 3.37Å; K87-Y91 HydrophobicContact CG-CD2 4.43Å; K87-Y91 HydrophobicContact CG-CE2 3.94Å; K87-Y91 PolarHBondContact NZ-OH 3.3Å; K87-Y91 VanDerWaalsContact NZ-OH 3.17Å; K87-Y91 PolarHBondContact O-N 3.05Å
88	M	95	Very high	93.5	Very high	94 Å²	94	84.1 Å²	84.1	46%	0.463	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-34.9	172.7	-173.8	-171.1	-178.1	0	0	112.1	R84 N86 I92	R84-M88 WeakPolarHBondContact O-CB 3.37Å; R84-M88 PolarHBondContact O-N 2.83Å; N86-M88 PolarHBondContact O-N 3.14Å; M88-I92 VanDerWaalsContact O-CG1 3.22Å; M88-I92 WeakPolarHBondContact O-CG1 3.47Å; M88-I92 PolarHBondContact O-N 2.88Å; M88-I92 VanDerWaalsContact O-N 3.08Å
89	S	94.7	Very high	93.6	Very high	49 Å²	49	81.3 Å²	81.3	34%	0.343	38%	0.382	S	S	.	.	H	α-helix	trans	-72.8	-36	178.2	-57.2	0	0	0	0	112.3	R85 N86 K87 G93 K111	R85-S89 WeakPolarHBondContact O-CB 3.27Å; R85-S89 PolarHBondContact O-N 3.29Å; R85-S89 PolarHBondContact O-OG 3.08Å; N86-S89 WeakPolarHBondContact O-CA 3.5Å; N86-S89 WeakPolarHBondContact O-CB 3.31Å; N86-S89 PolarHBondContact O-N 3.48Å; K87-S89 VanDerWaalsContact C-N 3.26Å; K87-S89 PolarHBondContact O-N 3.45Å; S89-G93 PolarHBondContact O-N 3.42Å; S89-K111 PolarHBondContact OG-NZ 2.99Å
90	A	95.4	Very high	93.6	Very high	46 Å²	46	81.7 Å²	81.7	38%	0.38	39%	0.39	S	S	.	.	H	α-helix	trans	-62.1	-52.5	170.9	0	0	0	0	0	111.3	N86 K87 I92 G93 E94	N86-A90 PolarHBondContact O-N 2.95Å; K87-A90 PolarHBondContact O-N 2.95Å; A90-I92 VanDerWaalsContact C-N 3.3Å; A90-I92 PolarHBondContact O-N 2.97Å; A90-G93 CarbonylContact O-C 3.57Å; A90-G93 WeakPolarHBondContact O-CA 3.45Å; A90-G93 PolarHBondContact O-N 3.18Å; A90-E94 PolarHBondContact O-N 3.38Å
91	Y	96.8	Very high	93.6	Very high	123 Å²	123	80.1 Å²	80.1	48%	0.482	39%	0.387	S	S	.	.	H	α-helix	trans	-57.4	-37.2	177.3	-68.6	-31.1	0	0	0	113.8	K87 G93 L95	K87-Y91 HydrophobicContact CD-CE2 4.07Å; K87-Y91 WeakPolarHBondContact CE-OH 3.37Å; K87-Y91 HydrophobicContact CG-CD2 4.43Å; K87-Y91 HydrophobicContact CG-CE2 3.94Å; K87-Y91 PolarHBondContact NZ-OH 3.3Å; K87-Y91 VanDerWaalsContact NZ-OH 3.17Å; K87-Y91 PolarHBondContact O-N 3.05Å; Y91-G93 VanDerWaalsContact C-N 3.35Å; Y91-L95 WeakPolarHBondContact O-CB 3.25Å; Y91-L95 PolarHBondContact O-N 3.37Å
92	I	95	Very high	93.3	Very high	13 Å²	13	77.5 Å²	77.5	7%	0.067	38%	0.375	C	S	.	.	H	α-helix	trans	-72.3	-29.9	174.8	-66.7	-71.4	0	0	0	111.7	M88 A90 L95 S96 K111 I114 L115	M88-I92 VanDerWaalsContact O-CG1 3.22Å; M88-I92 WeakPolarHBondContact O-CG1 3.47Å; M88-I92 PolarHBondContact O-N 2.88Å; M88-I92 VanDerWaalsContact O-N 3.08Å; A90-I92 VanDerWaalsContact C-N 3.3Å; A90-I92 PolarHBondContact O-N 2.97Å; I92-L95 HydrophobicContact CD1-CD2 4.5Å; I92-S96 WeakPolarHBondContact O-CB 3.41Å; I92-S96 PolarHBondContact O-N 3.07Å; I92-K111 HydrophobicContact CG2-CB 4.15Å; I92-K111 HydrophobicContact CG2-CD 4.43Å; I92-K111 HydrophobicContact CG2-CG 3.92Å; I92-I114 HydrophobicContact CG2-CB 4.36Å; I92-I114 HydrophobicContact CG2-CD1 3.64Å; I92-I114 HydrophobicContact CG2-CG2 4.22Å; I92-L115 HydrophobicContact CD1-CD1 4.11Å; I92-L115 HydrophobicContact CD1-CD2 3.72Å; I92-L115 HydrophobicContact CD1-CG 3.79Å
93	G	93.6	Very high	93.2	Very high	22 Å²	22	74.3 Å²	74.3	23%	0.227	37%	0.372	C	S	.	.	H	α-helix	trans	-64.7	-56	170.4	0	0	0	0	0	111.9	S89 A90 Y91 L95 S96 D97	S89-G93 PolarHBondContact O-N 3.42Å; A90-G93 CarbonylContact O-C 3.57Å; A90-G93 WeakPolarHBondContact O-CA 3.45Å; A90-G93 PolarHBondContact O-N 3.18Å; Y91-G93 VanDerWaalsContact C-N 3.35Å; G93-L95 VanDerWaalsContact C-N 3.3Å; G93-L95 PolarHBondContact O-N 2.66Å; G93-S96 WeakPolarHBondContact O-CB 3.25Å; G93-S96 PolarHBondContact O-N 3.1Å; G93-D97 VanDerWaalsContact O-CG 3.26Å; G93-D97 PolarHBondContact O-N 3.24Å; G93-D97 VanDerWaalsContact O-N 3.09Å
94	E	96	Very high	92.9	Very high	102 Å²	102	71.2 Å²	71.2	48%	0.477	38%	0.38	S	S	.	.	H	α-helix	trans	-54.9	-44.3	176.1	-68.2	160.6	-144.5	0	0	111.5	A90 S96 D97 M98	A90-E94 PolarHBondContact O-N 3.38Å; E94-S96 PolarHBondContact O-N 3.08Å; E94-D97 PolarHBondContact O-N 3.23Å; E94-D97 VanDerWaalsContact O-N 3.14Å; E94-M98 HydrophobicContact CB-CE 4.27Å; E94-M98 WeakPolarHBondContact O-CG 3.4Å; E94-M98 PolarHBondContact O-N 3.16Å
95	L	94.6	Very high	92.6	Very high	48 Å²	48	68.2 Å²	68.2	25%	0.251	37%	0.374	S	S	.	.	H	α-helix	trans	-64.3	-37.5	176.4	-176.4	63.6	0	0	0	112.9	Y91 I92 G93 D97 V99 I114 L115 A118	Y91-L95 WeakPolarHBondContact O-CB 3.25Å; Y91-L95 PolarHBondContact O-N 3.37Å; I92-L95 HydrophobicContact CD1-CD2 4.5Å; G93-L95 VanDerWaalsContact C-N 3.3Å; G93-L95 PolarHBondContact O-N 2.66Å; L95-D97 PolarHBondContact O-N 3.14Å; L95-V99 HydrophobicContact CD1-CG2 4.04Å; L95-V99 HydrophobicContact CG-CG2 4.46Å; L95-V99 WeakPolarHBondContact O-CB 3.24Å; L95-V99 VanDerWaalsContact O-CG2 3.24Å; L95-V99 WeakPolarHBondContact O-CG2 3.49Å; L95-V99 PolarHBondContact O-N 2.94Å; L95-V99 VanDerWaalsContact O-N 3.15Å; L95-I114 HydrophobicContact CD2-CG2 4.35Å; L95-I114 HydrophobicContact CG-CG2 4.28Å; L95-L115 HydrophobicContact CD2-CD2 4Å; L95-A118 HydrophobicContact CD1-CB 3.97Å; L95-A118 HydrophobicContact CD2-CB 3.89Å; L95-A118 HydrophobicContact CG-CB 4.02Å
96	S	94.1	Very high	92	Very high	1 Å²	1	67.9 Å²	67.9	1%	0.007	40%	0.397	C	S	.	.	H	α-helix	trans	-64.8	-30	174	-173.7	0	0	0	0	112.3	I92 G93 E94 C102 S103	I92-S96 WeakPolarHBondContact O-CB 3.41Å; I92-S96 PolarHBondContact O-N 3.07Å; G93-S96 WeakPolarHBondContact O-CB 3.25Å; G93-S96 PolarHBondContact O-N 3.1Å; E94-S96 PolarHBondContact O-N 3.08Å; S96-C102 CarbonylContact O-C 3.6Å; S96-C102 WeakPolarHBondContact O-CB 3.2Å; S96-S103 PolarHBondContact O-N 3.2Å
97	D	93.4	Very high	91.7	Very high	83 Å²	83	73.7 Å²	73.7	44%	0.444	41%	0.411	S	S	.	.	H	α-helix	trans	-88.4	-31	-174.9	-61.6	-13.4	0	0	0	110.9	G93 E94 L95 S103 K108	G93-D97 VanDerWaalsContact O-CG 3.26Å; G93-D97 PolarHBondContact O-N 3.24Å; G93-D97 VanDerWaalsContact O-N 3.09Å; E94-D97 PolarHBondContact O-N 3.23Å; E94-D97 VanDerWaalsContact O-N 3.14Å; L95-D97 PolarHBondContact O-N 3.14Å; D97-S103 WeakPolarHBondContact O-CB 3.38Å; D97-S103 PolarHBondContact O-OG 2.79Å; D97-K108 WeakPolarHBondContact OD1-CE 3.28Å; D97-K108 IonicContact OD1-NZ 3.09Å; D97-K108 PolarHBondContact OD1-NZ 2.95Å; D97-K108 IonicContact OD2-NZ 3.47Å; D97-K108 PolarHBondContact OD2-NZ 3.27Å
98	M	90.4	Very high	91.2	Very high	134 Å²	134	74 Å²	74	66%	0.66	41%	0.412	S	S	*	.	H	α-helix	trans	-75.6	-24.8	172	-72.4	-172.6	-72	0	0	115	E94 P100	E94-M98 HydrophobicContact CB-CE 4.27Å; E94-M98 WeakPolarHBondContact O-CG 3.4Å; E94-M98 PolarHBondContact O-N 3.16Å; M98-P100 WeakPolarHBondContact O-CD 3.49Å
99	V	91.3	Very high	91	Very high	5 Å²	5	70.8 Å²	70.8	3%	0.03	40%	0.398	C	S	.	.	S	Bend	trans	-88.9	113.2	-179.2	172.2	0	0	0	0	109.7	L95 S101 C102 S103 A118 H121	L95-V99 HydrophobicContact CD1-CG2 4.04Å; L95-V99 HydrophobicContact CG-CG2 4.46Å; L95-V99 WeakPolarHBondContact O-CB 3.24Å; L95-V99 VanDerWaalsContact O-CG2 3.24Å; L95-V99 WeakPolarHBondContact O-CG2 3.49Å; L95-V99 PolarHBondContact O-N 2.94Å; L95-V99 VanDerWaalsContact O-N 3.15Å; V99-S101 VanDerWaalsContact C-N 3.27Å; V99-S101 PolarHBondContact O-N 2.82Å; V99-S101 VanDerWaalsContact O-N 3.12Å; V99-C102 HydrophobicContact CB-CB 4.12Å; V99-C102 HydrophobicContact CG1-CB 4.2Å; V99-C102 WeakPolarHBondContact O-CA 3.26Å; V99-C102 WeakPolarHBondContact O-CB 3.21Å; V99-C102 PolarHBondContact O-N 3.37Å; V99-S103 PolarHBondContact O-N 3.15Å; V99-S103 PolarHBondContact O-OG 3.33Å; V99-A118 HydrophobicContact CG2-CB 3.89Å; V99-H121 HydrophobicContact CG1-CB 4.14Å
100	P	88.1	Confident	91	Very high	73 Å²	73	72.8 Å²	72.8	47%	0.474	41%	0.405	S	S	.	.	H	α-helix	trans	-59.7	-32.6	-169.7	-26.9	35.8	0	0	0	114.7	M98 C102 A104 H121	M98-P100 WeakPolarHBondContact O-CD 3.49Å; P100-C102 VanDerWaalsContact C-N 3.31Å; P100-A104 VanDerWaalsContact O-CB 3.26Å; P100-A104 WeakPolarHBondContact O-CB 3.49Å; P100-A104 PolarHBondContact O-N 3.01Å; P100-H121 WeakPolarHBondContact CD-NE2 3.42Å
101	S	87	Confident	90.9	Very high	58 Å²	58	75.4 Å²	75.4	41%	0.406	41%	0.408	S	S	.	.	H	α-helix	trans	-74.1	-21	176.6	54.4	0	0	0	0	113.4	V99 M117	V99-S101 VanDerWaalsContact C-N 3.27Å; V99-S101 PolarHBondContact O-N 2.82Å; V99-S101 VanDerWaalsContact O-N 3.12Å; S101-M117 WeakPolarHBondContact O-CE 3.37Å
102	C	88	Confident	90.8	Very high	1 Å²	1	74 Å²	74	1%	0.007	41%	0.408	C	S	.	.	H	α-helix	trans	-87.2	-44.8	173.6	-66.1	0	0	0	0	111.6	S96 V99 P100 A104 L105 M117	S96-C102 CarbonylContact O-C 3.6Å; S96-C102 WeakPolarHBondContact O-CB 3.2Å; V99-C102 HydrophobicContact CB-CB 4.12Å; V99-C102 HydrophobicContact CG1-CB 4.2Å; V99-C102 WeakPolarHBondContact O-CA 3.26Å; V99-C102 WeakPolarHBondContact O-CB 3.21Å; V99-C102 PolarHBondContact O-N 3.37Å; P100-C102 VanDerWaalsContact C-N 3.31Å; C102-A104 VanDerWaalsContact C-N 3.34Å; C102-A104 PolarHBondContact O-N 3.28Å; C102-L105 WeakPolarHBondContact O-CB 3.34Å; C102-L105 PolarHBondContact O-N 3.12Å; C102-M117 WeakPolarHBondContact SG-CB 3.42Å
103	S	89.8	Confident	90.8	Very high	62 Å²	62	75.4 Å²	75.4	43%	0.434	42%	0.418	S	S	.	.	H	α-helix	trans	-72.4	-25.3	-175.8	58.1	0	0	0	0	113.7	S96 D97 V99 L105	S96-S103 PolarHBondContact O-N 3.2Å; D97-S103 WeakPolarHBondContact O-CB 3.38Å; D97-S103 PolarHBondContact O-OG 2.79Å; V99-S103 PolarHBondContact O-N 3.15Å; V99-S103 PolarHBondContact O-OG 3.33Å; S103-L105 PolarHBondContact O-N 3.47Å
104	A	86.8	Confident	90.8	Very high	87 Å²	87	74.7 Å²	74.7	72%	0.719	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-4.8	172.2	0	0	0	0	0	114.6	P100 C102	P100-A104 VanDerWaalsContact O-CB 3.26Å; P100-A104 WeakPolarHBondContact O-CB 3.49Å; P100-A104 PolarHBondContact O-N 3.01Å; C102-A104 VanDerWaalsContact C-N 3.34Å; C102-A104 PolarHBondContact O-N 3.28Å
105	L	88.4	Confident	90.8	Very high	85 Å²	85	73.2 Å²	73.2	45%	0.445	40%	0.403	S	S	.	.	S	Bend	trans	-88.2	123.7	179.8	-67	170.4	0	0	0	111.8	C102 S103 R107 P109 M117	C102-L105 WeakPolarHBondContact O-CB 3.34Å; C102-L105 PolarHBondContact O-N 3.12Å; S103-L105 PolarHBondContact O-N 3.47Å; L105-R107 PolarHBondContact O-N 3.03Å; L105-P109 HydrophobicContact CD1-CB 4.39Å; L105-P109 HydrophobicContact CD1-CG 3.91Å; L105-M117 HydrophobicContact CD1-CE 4.14Å
106	A	82.2	Confident	90.8	Very high	111 Å²	111	78.6 Å²	78.6	92%	0.917	42%	0.42	S	S	*	.	S	Bend	trans	-63.5	-0.3	177.6	0	0	0	0	0	115.4
107	R	89.5	Confident	90.7	Very high	226 Å²	226	80.5 Å²	80.5	85%	0.853	43%	0.43	S	S	*	.	S	Bend	trans	-139.6	129.2	166.5	-67.8	-176	177.4	178	-0.9	107.8	L105 P109	L105-R107 PolarHBondContact O-N 3.03Å; R107-P109 WeakPolarHBondContact O-CD 3.47Å
108	K	85.3	Confident	90.7	Very high	131 Å²	131	76.7 Å²	76.7	57%	0.57	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-60.2	124.5	177.1	-67	-155.6	175.6	-157.4	0	109.8	D97	D97-K108 WeakPolarHBondContact OD1-CE 3.28Å; D97-K108 IonicContact OD1-NZ 3.09Å; D97-K108 PolarHBondContact OD1-NZ 2.95Å; D97-K108 IonicContact OD2-NZ 3.47Å; D97-K108 PolarHBondContact OD2-NZ 3.27Å
109	P	91.3	Very high	90.7	Very high	26 Å²	26	73.6 Å²	73.6	17%	0.169	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-69.5	169.6	179	24.1	-28.5	0	0	0	111.9	L105 R107 T113 I114	L105-P109 HydrophobicContact CD1-CB 4.39Å; L105-P109 HydrophobicContact CD1-CG 3.91Å; R107-P109 WeakPolarHBondContact O-CD 3.47Å; P109-T113 HydrophobicContact CB-CG2 3.8Å; P109-I114 HydrophobicContact CB-CG1 4.46Å; P109-I114 HydrophobicContact CG-CG1 3.79Å; P109-I114 VanDerWaalsContact O-CD1 3.29Å; P109-I114 WeakPolarHBondContact O-CD1 3.48Å
110	D	94.4	Very high	90.6	Very high	91 Å²	91	77.1 Å²	77.1	49%	0.487	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-67.7	160.1	178.3	74.5	-91.1	0	0	0	112.4	L112 T113 I114	D110-L112 VanDerWaalsContact C-N 3.26Å; D110-L112 PolarHBondContact O-N 3.39Å; D110-L112 WeakPolarHBondContact OD2-CA 3.5Å; D110-L112 WeakPolarHBondContact OD2-CB 3.34Å; D110-L112 PolarHBondContact OD2-N 3.27Å; D110-T113 PolarHBondContact O-N 3.3Å; D110-T113 VanDerWaalsContact O-N 3.1Å; D110-T113 WeakPolarHBondContact OD1-CB 3.48Å; D110-T113 PolarHBondContact OD1-OG1 3.07Å; D110-T113 PolarHBondContact OD2-N 3.45Å; D110-I114 WeakPolarHBondContact O-CG1 3.43Å; D110-I114 PolarHBondContact O-N 2.78Å
111	K	93.5	Very high	90.6	Very high	101 Å²	101	76.4 Å²	76.4	44%	0.439	41%	0.413	S	S	.	.	H	α-helix	trans	-58.4	-32.6	-174.9	-60.4	-167.5	170.9	-178.5	0	114.1	S89 I92 L115	S89-K111 PolarHBondContact OG-NZ 2.99Å; I92-K111 HydrophobicContact CG2-CB 4.15Å; I92-K111 HydrophobicContact CG2-CD 4.43Å; I92-K111 HydrophobicContact CG2-CG 3.92Å; K111-L115 WeakPolarHBondContact O-CG 3.44Å; K111-L115 PolarHBondContact O-N 2.69Å
112	L	94.8	Very high	90.4	Very high	95 Å²	95	78 Å²	78	50%	0.497	42%	0.415	S	S	.	.	H	α-helix	trans	-78	-37.5	178.8	178.4	61.3	0	0	0	110.8	D110 L115 R116	D110-L112 VanDerWaalsContact C-N 3.26Å; D110-L112 PolarHBondContact O-N 3.39Å; D110-L112 WeakPolarHBondContact OD2-CA 3.5Å; D110-L112 WeakPolarHBondContact OD2-CB 3.34Å; D110-L112 PolarHBondContact OD2-N 3.27Å; L112-L115 PolarHBondContact O-N 3.4Å; L112-R116 WeakPolarHBondContact O-CB 3.44Å; L112-R116 VanDerWaalsContact O-CG 3.27Å; L112-R116 WeakPolarHBondContact O-CG 3.49Å; L112-R116 PolarHBondContact O-N 2.85Å
113	T	93.7	Very high	90.1	Very high	42 Å²	42	85 Å²	85	26%	0.258	45%	0.446	S	S	.	.	H	α-helix	trans	-66.2	-42.5	173.4	-65	0	0	0	0	111.8	P109 D110 L115 R116 M117	P109-T113 HydrophobicContact CB-CG2 3.8Å; D110-T113 PolarHBondContact O-N 3.3Å; D110-T113 VanDerWaalsContact O-N 3.1Å; D110-T113 WeakPolarHBondContact OD1-CB 3.48Å; D110-T113 PolarHBondContact OD1-OG1 3.07Å; D110-T113 PolarHBondContact OD2-N 3.45Å; T113-L115 VanDerWaalsContact C-N 3.33Å; T113-L115 PolarHBondContact O-N 2.72Å; T113-R116 PolarHBondContact O-N 2.94Å; T113-M117 HydrophobicContact CG2-CG 4.26Å; T113-M117 HydrophobicContact CG2-SD 3.54Å; T113-M117 VanDerWaalsContact CG2-SD 3.54Å; T113-M117 WeakPolarHBondContact O-CB 3.36Å; T113-M117 VanDerWaalsContact O-CG 3.27Å; T113-M117 WeakPolarHBondContact O-CG 3.31Å; T113-M117 PolarHBondContact O-N 2.97Å
114	I	94.6	Very high	89.7	Confident	7 Å²	7	86.6 Å²	86.6	4%	0.036	46%	0.457	C	S	.	.	H	α-helix	trans	-54	-50.1	171.7	-65.9	162.7	0	0	0	110.4	I92 L95 P109 D110 R116 M117 A118	I92-I114 HydrophobicContact CG2-CB 4.36Å; I92-I114 HydrophobicContact CG2-CD1 3.64Å; I92-I114 HydrophobicContact CG2-CG2 4.22Å; L95-I114 HydrophobicContact CD2-CG2 4.35Å; L95-I114 HydrophobicContact CG-CG2 4.28Å; P109-I114 HydrophobicContact CB-CG1 4.46Å; P109-I114 HydrophobicContact CG-CG1 3.79Å; P109-I114 VanDerWaalsContact O-CD1 3.29Å; P109-I114 WeakPolarHBondContact O-CD1 3.48Å; D110-I114 WeakPolarHBondContact O-CG1 3.43Å; D110-I114 PolarHBondContact O-N 2.78Å; I114-R116 PolarHBondContact O-N 3.05Å; I114-M117 PolarHBondContact O-N 3.08Å; I114-A118 WeakPolarHBondContact O-CB 3.12Å; I114-A118 PolarHBondContact O-N 3.32Å
115	L	95.7	Very high	88.9	Confident	70 Å²	70	88.6 Å²	88.6	37%	0.366	46%	0.455	S	S	.	.	H	α-helix	trans	-62.8	-41.1	178.5	-73.6	169.7	0	0	0	112.9	I92 L95 K111 L112 T113 A118 V119	I92-L115 HydrophobicContact CD1-CD1 4.11Å; I92-L115 HydrophobicContact CD1-CD2 3.72Å; I92-L115 HydrophobicContact CD1-CG 3.79Å; L95-L115 HydrophobicContact CD2-CD2 4Å; K111-L115 WeakPolarHBondContact O-CG 3.44Å; K111-L115 PolarHBondContact O-N 2.69Å; L112-L115 PolarHBondContact O-N 3.4Å; T113-L115 VanDerWaalsContact C-N 3.33Å; T113-L115 PolarHBondContact O-N 2.72Å; L115-A118 PolarHBondContact O-N 2.84Å; L115-V119 WeakPolarHBondContact O-CB 3.44Å; L115-V119 VanDerWaalsContact O-CG2 3.3Å; L115-V119 WeakPolarHBondContact O-CG2 3.3Å; L115-V119 PolarHBondContact O-N 2.76Å
116	R	93.8	Very high	88	Confident	161 Å²	161	89.7 Å²	89.7	61%	0.608	45%	0.453	S	S	*	.	H	α-helix	trans	-63.4	-41.8	176.2	-75.4	168.2	172.1	-178.3	-3.1	112	L112 T113 I114 V119 S120	L112-R116 WeakPolarHBondContact O-CB 3.44Å; L112-R116 VanDerWaalsContact O-CG 3.27Å; L112-R116 WeakPolarHBondContact O-CG 3.49Å; L112-R116 PolarHBondContact O-N 2.85Å; T113-R116 PolarHBondContact O-N 2.94Å; I114-R116 PolarHBondContact O-N 3.05Å; R116-V119 PolarHBondContact O-N 3.29Å; R116-S120 PolarHBondContact O-N 3.27Å
117	M	92.9	Very high	86.8	Confident	42 Å²	42	86.5 Å²	86.5	21%	0.207	43%	0.43	C	S	.	.	H	α-helix	trans	-71	-39.3	178.6	-68.6	172.1	73.9	0	0	111.6	S101 C102 L105 T113 I114 S120 H121	S101-M117 WeakPolarHBondContact O-CE 3.37Å; C102-M117 WeakPolarHBondContact SG-CB 3.42Å; L105-M117 HydrophobicContact CD1-CE 4.14Å; T113-M117 HydrophobicContact CG2-CG 4.26Å; T113-M117 HydrophobicContact CG2-SD 3.54Å; T113-M117 VanDerWaalsContact CG2-SD 3.54Å; T113-M117 WeakPolarHBondContact O-CB 3.36Å; T113-M117 VanDerWaalsContact O-CG 3.27Å; T113-M117 WeakPolarHBondContact O-CG 3.31Å; T113-M117 PolarHBondContact O-N 2.97Å; I114-M117 PolarHBondContact O-N 3.08Å; M117-S120 WeakPolarHBondContact O-CB 3.46Å; M117-S120 PolarHBondContact O-N 2.66Å; M117-H121 WeakPolarHBondContact O-CB 3.19Å; M117-H121 PolarHBondContact O-N 2.87Å
118	A	92.6	Very high	85.1	Confident	3 Å²	3	83.9 Å²	83.9	3%	0.025	43%	0.434	C	S	.	.	H	α-helix	trans	-60.6	-43.8	170.8	0	0	0	0	0	112.4	L95 V99 I114 L115 S120 H121 M122	L95-A118 HydrophobicContact CD1-CB 3.97Å; L95-A118 HydrophobicContact CD2-CB 3.89Å; L95-A118 HydrophobicContact CG-CB 4.02Å; V99-A118 HydrophobicContact CG2-CB 3.89Å; I114-A118 WeakPolarHBondContact O-CB 3.12Å; I114-A118 PolarHBondContact O-N 3.32Å; L115-A118 PolarHBondContact O-N 2.84Å; A118-S120 VanDerWaalsContact C-N 3.34Å; A118-S120 PolarHBondContact O-N 3.27Å; A118-H121 PolarHBondContact O-N 2.89Å; A118-M122 WeakPolarHBondContact O-CB 3.23Å; A118-M122 WeakPolarHBondContact O-CG 3.23Å; A118-M122 PolarHBondContact O-N 2.8Å
119	V	91.1	Very high	83.5	Confident	69 Å²	69	80.2 Å²	80.2	42%	0.418	43%	0.428	S	S	.	.	H	α-helix	trans	-63.9	-38.8	174.3	167.6	0	0	0	0	111.6	L115 R116 M122 K123	L115-V119 WeakPolarHBondContact O-CB 3.44Å; L115-V119 VanDerWaalsContact O-CG2 3.3Å; L115-V119 WeakPolarHBondContact O-CG2 3.3Å; L115-V119 PolarHBondContact O-N 2.76Å; R116-V119 PolarHBondContact O-N 3.29Å; V119-M122 HydrophobicContact CG2-CE 4.21Å; V119-K123 HydrophobicContact CG1-CD 4.38Å; V119-K123 WeakPolarHBondContact O-CG 3.35Å; V119-K123 PolarHBondContact O-N 2.91Å
120	S	89.3	Confident	81.5	Confident	78 Å²	78	86.4 Å²	86.4	55%	0.545	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-46.8	174.1	-163.3	0	0	0	0	111.7	R116 M117 A118 M122 K123 S124	R116-S120 PolarHBondContact O-N 3.27Å; M117-S120 WeakPolarHBondContact O-CB 3.46Å; M117-S120 PolarHBondContact O-N 2.66Å; A118-S120 VanDerWaalsContact C-N 3.34Å; A118-S120 PolarHBondContact O-N 3.27Å; S120-M122 PolarHBondContact O-N 2.88Å; S120-K123 PolarHBondContact O-N 2.84Å; S120-S124 PolarHBondContact O-N 2.81Å
121	H	86.8	Confident	79.3	Confident	59 Å²	59	86.3 Å²	86.3	27%	0.273	46%	0.462	S	S	.	.	H	α-helix	trans	-60	-47.1	176.7	-171.6	-115.8	0	0	0	111.8	V99 P100 M117 A118 K123 S124 L125	V99-H121 HydrophobicContact CG1-CB 4.14Å; P100-H121 WeakPolarHBondContact CD-NE2 3.42Å; M117-H121 WeakPolarHBondContact O-CB 3.19Å; M117-H121 PolarHBondContact O-N 2.87Å; A118-H121 PolarHBondContact O-N 2.89Å; H121-K123 VanDerWaalsContact C-N 3.31Å; H121-K123 PolarHBondContact O-N 2.92Å; H121-S124 WeakPolarHBondContact O-CB 3.42Å; H121-S124 PolarHBondContact O-N 2.69Å; H121-S124 VanDerWaalsContact O-N 3.12Å; H121-L125 WeakPolarHBondContact O-CD1 3.33Å; H121-L125 PolarHBondContact O-N 2.71Å
122	M	83.6	Confident	77.1	Confident	91 Å²	91	89.3 Å²	89.3	45%	0.448	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-32.3	175.5	-75.6	-169.5	-70.9	0	0	113.6	A118 V119 S120 R126	A118-M122 WeakPolarHBondContact O-CB 3.23Å; A118-M122 WeakPolarHBondContact O-CG 3.23Å; A118-M122 PolarHBondContact O-N 2.8Å; V119-M122 HydrophobicContact CG2-CE 4.21Å; S120-M122 PolarHBondContact O-N 2.88Å; M122-R126 VanDerWaalsContact O-CB 3.3Å; M122-R126 WeakPolarHBondContact O-CB 3.42Å; M122-R126 PolarHBondContact O-N 2.83Å; M122-R126 VanDerWaalsContact O-N 3.12Å
123	K	82.8	Confident	74.7	Confident	148 Å²	148	88.5 Å²	88.5	64%	0.643	49%	0.49	S	S	*	.	H	α-helix	trans	-70.6	-38.4	172.5	-76.4	178.4	177.3	-171.5	0	111.7	V119 S120 H121 G127	V119-K123 HydrophobicContact CG1-CD 4.38Å; V119-K123 WeakPolarHBondContact O-CG 3.35Å; V119-K123 PolarHBondContact O-N 2.91Å; S120-K123 PolarHBondContact O-N 2.84Å; H121-K123 VanDerWaalsContact C-N 3.31Å; H121-K123 PolarHBondContact O-N 2.92Å; K123-G127 PolarHBondContact O-N 3.5Å; K123-G127 VanDerWaalsContact O-N 3.08Å
124	S	80.1	Confident	72.3	Confident	96 Å²	96	94 Å²	94	67%	0.671	52%	0.518	S	S	*	.	H	α-helix	trans	-63.6	-43.8	175.1	-162.7	0	0	0	0	112.1	S120 H121	S120-S124 PolarHBondContact O-N 2.81Å; H121-S124 WeakPolarHBondContact O-CB 3.42Å; H121-S124 PolarHBondContact O-N 2.69Å; H121-S124 VanDerWaalsContact O-N 3.12Å
125	L	71.6	Confident	70.1	Confident	129 Å²	129	97.7 Å²	97.7	68%	0.675	56%	0.558	S	S	*	*	H	α-helix	trans	-68.5	-39.4	178.2	-96	63.9	0	0	0	113.2	H121	H121-L125 WeakPolarHBondContact O-CD1 3.33Å; H121-L125 PolarHBondContact O-N 2.71Å
126	R	68.5	Low	68.2	Low	108 Å²	108	98 Å²	98	41%	0.408	57%	0.566	S	S	.	*	H	α-helix	trans	-84.4	-11.6	-176.4	-148.8	179.9	-49.1	-97.1	-4.7	113.5	M122 A129 S140	M122-R126 VanDerWaalsContact O-CB 3.3Å; M122-R126 WeakPolarHBondContact O-CB 3.42Å; M122-R126 PolarHBondContact O-N 2.83Å; M122-R126 VanDerWaalsContact O-N 3.12Å; R126-A129 WeakPolarHBondContact O-CB 3.08Å; R126-S140 PolarHBondContact NH1-O 2.92Å; R126-S140 PolarHBondContact NH1-OG 3.31Å
127	G	57.5	Low	66.5	Low	43 Å²	43	99.7 Å²	99.7	44%	0.443	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	61.4	-169.1	-171.1	0	0	0	0	0	113.1	K123 A129	K123-G127 PolarHBondContact O-N 3.5Å; K123-G127 VanDerWaalsContact O-N 3.08Å; G127-A129 PolarHBondContact O-N 2.98Å
128	N	53.9	Low	64.5	Low	172 Å²	172	100.8 Å²	100.8	92%	0.92	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	32	178.4	-108.7	78	0	0	0	113.5	N130	N128-N130 PolarHBondContact O-N 3.21Å
129	A	50.8	Low	62.9	Low	54 Å²	54	103.3 Å²	103.3	45%	0.446	59%	0.593	S	S	.	*			trans	-76.9	87.1	-171.6	0	0	0	0	0	112.7	R126 G127 T131	R126-A129 WeakPolarHBondContact O-CB 3.08Å; G127-A129 PolarHBondContact O-N 2.98Å; A129-T131 HydrophobicContact CB-CG2 4.27Å; A129-T131 PolarHBondContact O-N 3.33Å
130	N	49.1	Very low	61.3	Low	155 Å²	155	102.9 Å²	102.9	83%	0.829	59%	0.594	S	S	*	*			trans	-69.7	77.9	163.8	-84.8	-3.7	0	0	0	110.4	N128 N132	N128-N130 PolarHBondContact O-N 3.21Å; N130-N132 VanDerWaalsContact C-N 3.34Å; N130-N132 PolarHBondContact O-N 2.94Å
131	T	48.5	Very low	60.2	Low	90 Å²	90	106.5 Å²	106.5	55%	0.552	60%	0.6	S	S	*	*			trans	-80.4	78	176.3	54.4	0	0	0	0	111.4	A129	A129-T131 HydrophobicContact CB-CG2 4.27Å; A129-T131 PolarHBondContact O-N 3.33Å
132	N	46.4	Very low	59.2	Low	164 Å²	164	105 Å²	105	88%	0.877	59%	0.593	S	S	*	*			trans	-124.9	51.9	171	-87	-37.6	0	0	0	111.4	N130	N130-N132 VanDerWaalsContact C-N 3.34Å; N130-N132 PolarHBondContact O-N 2.94Å
133	A	44.4	Very low	58.8	Low	77 Å²	77	103 Å²	103	64%	0.636	59%	0.588	S	S	*	*	S	Bend	trans	-157.7	156.1	162	0	0	0	0	0	109.1
134	D	43.4	Very low	58.3	Low	157 Å²	157	99.9 Å²	99.9	84%	0.84	58%	0.579	S	S	*	*	S	Bend	trans	50.4	64.7	160.4	-59.1	-17	0	0	0	118.9	S136	D134-S136 VanDerWaalsContact C-N 3.27Å; D134-S136 PolarHBondContact O-N 2.76Å
135	G	50.3	Low	57.9	Low	86 Å²	86	102.9 Å²	102.9	89%	0.887	58%	0.582	S	S	*	*			trans	51.8	30.7	133.1	0	0	0	0	0	118.7	Y137	G135-Y137 PolarHBondContact O-N 3.43Å
136	S	54	Low	58.2	Low	75 Å²	75	101.7 Å²	101.7	52%	0.524	57%	0.573	S	S	.	*			trans	-69.4	123.2	-171.4	58.2	0	0	0	0	112	D134 K138	D134-S136 VanDerWaalsContact C-N 3.27Å; D134-S136 PolarHBondContact O-N 2.76Å; S136-K138 PolarHBondContact O-N 2.88Å
137	Y	58.3	Low	58.5	Low	197 Å²	197	97.6 Å²	97.6	77%	0.773	56%	0.559	S	S	*	*	S	Bend	trans	-65.7	5.4	176.9	58.5	-94.4	0	0	0	114.2	G135 L147	G135-Y137 PolarHBondContact O-N 3.43Å; Y137-L147 HydrophobicContact CD2-CD2 4.35Å; Y137-L147 HydrophobicContact CE2-CD2 4.26Å
138	K	52	Low	59.2	Low	65 Å²	65	98.6 Å²	98.6	28%	0.283	55%	0.551	S	S	.	*	S	Bend	trans	-106.6	113.3	-167.6	-179.4	-172.2	-172.7	172.1	0	109.5	S136 S140 L142 D144 L147	S136-K138 PolarHBondContact O-N 2.88Å; K138-S140 PolarHBondContact O-N 2.82Å; K138-L142 WeakPolarHBondContact CE-O 3.39Å; K138-D144 VanDerWaalsContact CD-OD1 3.25Å; K138-D144 WeakPolarHBondContact CD-OD1 3.11Å; K138-D144 WeakPolarHBondContact CE-OD1 3.29Å; K138-D144 IonicContact NZ-OD1 3.96Å; K138-D144 PolarHBondContact NZ-OD1 3.05Å; K138-D144 IonicContact NZ-OD2 2.69Å; K138-D144 PolarHBondContact NZ-OD2 2.77Å; K138-L147 HydrophobicContact CB-CD2 4.44Å; K138-L147 HydrophobicContact CG-CD2 4.26Å
139	P	58	Low	60.1	Low	57 Å²	57	96.2 Å²	96.2	37%	0.37	53%	0.534	S	S	.	.			trans	-67.4	125.8	171.1	30.6	-33.8	0	0	0	108.5	F141 L142	P139-F141 HydrophobicContact CB-CD1 3.78Å; P139-F141 HydrophobicContact CB-CE1 3.64Å; P139-F141 HydrophobicContact CG-CD1 4.28Å; P139-F141 HydrophobicContact CG-CE1 3.87Å; P139-F141 PolarHBondContact O-N 3.03Å; P139-L142 HydrophobicContact CG-CD1 4.14Å; P139-L142 PolarHBondContact O-N 3.14Å; P139-L142 VanDerWaalsContact O-N 3.08Å
140	S	58.1	Low	61.4	Low	60 Å²	60	97.8 Å²	97.8	42%	0.42	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	31.5	-169.8	58.8	0	0	0	0	115.1	R126 K138	R126-S140 PolarHBondContact NH1-O 2.92Å; R126-S140 PolarHBondContact NH1-OG 3.31Å; K138-S140 PolarHBondContact O-N 2.82Å
141	F	65.8	Low	62.5	Low	154 Å²	154	93.9 Å²	93.9	68%	0.675	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	-12.2	164.9	77.9	-92	0	0	0	113	P139	P139-F141 HydrophobicContact CB-CD1 3.78Å; P139-F141 HydrophobicContact CB-CE1 3.64Å; P139-F141 HydrophobicContact CG-CD1 4.28Å; P139-F141 HydrophobicContact CG-CE1 3.87Å; P139-F141 PolarHBondContact O-N 3.03Å
142	L	66.6	Low	63.5	Low	27 Å²	27	90 Å²	90	14%	0.141	49%	0.489	C	S	.	.	S	Bend	trans	-107.4	137.4	174.4	-63.4	175.5	0	0	0	110.4	K138 P139 E146 L147 L150	K138-L142 WeakPolarHBondContact CE-O 3.39Å; P139-L142 HydrophobicContact CG-CD1 4.14Å; P139-L142 PolarHBondContact O-N 3.14Å; P139-L142 VanDerWaalsContact O-N 3.08Å; L142-E146 HydrophobicContact CD2-CB 4.12Å; L142-L147 HydrophobicContact CB-CB 4.21Å; L142-L147 HydrophobicContact CD1-CB 4.29Å; L142-L147 HydrophobicContact CD1-CD1 3.9Å; L142-L150 HydrophobicContact CD1-CD2 3.96Å
143	S	75.6	Confident	64.7	Low	48 Å²	48	86.1 Å²	86.1	34%	0.336	47%	0.466	S	S	.	.			trans	-67.7	164.6	159.4	68.2	0	0	0	0	110.9	Q145 E146 L147	S143-Q145 PolarHBondContact O-N 3.15Å; S143-E146 WeakPolarHBondContact CB-OE2 3.26Å; S143-E146 PolarHBondContact N-OE2 2.9Å; S143-E146 PolarHBondContact O-N 3.35Å; S143-E146 WeakPolarHBondContact OG-CG 3.46Å; S143-E146 PolarHBondContact OG-N 3.43Å; S143-E146 VanDerWaalsContact OG-N 3.08Å; S143-E146 PolarHBondContact OG-OE2 3Å; S143-L147 VanDerWaalsContact O-CB 3.27Å; S143-L147 WeakPolarHBondContact O-CB 3.42Å; S143-L147 PolarHBondContact O-N 3.43Å
144	D	71.1	Confident	65.9	Low	84 Å²	84	86.4 Å²	86.4	45%	0.449	47%	0.468	S	S	.	.	H	α-helix	trans	-66.9	-24.4	175.9	-53.3	-65.5	0	0	0	111.9	K138 K148	K138-D144 VanDerWaalsContact CD-OD1 3.25Å; K138-D144 WeakPolarHBondContact CD-OD1 3.11Å; K138-D144 WeakPolarHBondContact CE-OD1 3.29Å; K138-D144 IonicContact NZ-OD1 3.96Å; K138-D144 PolarHBondContact NZ-OD1 3.05Å; K138-D144 IonicContact NZ-OD2 2.69Å; K138-D144 PolarHBondContact NZ-OD2 2.77Å; D144-K148 WeakPolarHBondContact O-CB 3.43Å; D144-K148 PolarHBondContact O-N 3.27Å
145	Q	72.3	Confident	66.9	Low	159 Å²	159	79.1 Å²	79.1	74%	0.743	43%	0.43	S	S	*	.	H	α-helix	trans	-78.1	-40.8	178	-171.7	169.4	-2.3	0	0	111.9	S143 H149	S143-Q145 PolarHBondContact O-N 3.15Å; Q145-H149 WeakPolarHBondContact O-CB 3.26Å; Q145-H149 PolarHBondContact O-N 3.31Å
146	E	76.8	Confident	67.9	Low	103 Å²	103	78.3 Å²	78.3	48%	0.481	41%	0.405	S	S	.	.	H	α-helix	trans	-67.4	-44	171.3	-68.4	157.7	122.9	0	0	111.1	L142 S143 K148 H149 L150	L142-E146 HydrophobicContact CD2-CB 4.12Å; S143-E146 WeakPolarHBondContact CB-OE2 3.26Å; S143-E146 PolarHBondContact N-OE2 2.9Å; S143-E146 PolarHBondContact O-N 3.35Å; S143-E146 WeakPolarHBondContact OG-CG 3.46Å; S143-E146 PolarHBondContact OG-N 3.43Å; S143-E146 VanDerWaalsContact OG-N 3.08Å; S143-E146 PolarHBondContact OG-OE2 3Å; E146-K148 VanDerWaalsContact C-N 3.33Å; E146-K148 PolarHBondContact O-N 3.29Å; E146-H149 PolarHBondContact O-N 3.19Å; E146-L150 VanDerWaalsContact O-CB 3.23Å; E146-L150 WeakPolarHBondContact O-CB 3.37Å; E146-L150 PolarHBondContact O-N 3.14Å
147	L	75.3	Confident	69.3	Low	22 Å²	22	74.7 Å²	74.7	12%	0.115	38%	0.38	C	S	.	.	H	α-helix	trans	-61.6	-41.4	175.7	-178.7	60.4	0	0	0	111.3	Y137 K138 L142 S143 I151	Y137-L147 HydrophobicContact CD2-CD2 4.35Å; Y137-L147 HydrophobicContact CE2-CD2 4.26Å; K138-L147 HydrophobicContact CB-CD2 4.44Å; K138-L147 HydrophobicContact CG-CD2 4.26Å; L142-L147 HydrophobicContact CB-CB 4.21Å; L142-L147 HydrophobicContact CD1-CB 4.29Å; L142-L147 HydrophobicContact CD1-CD1 3.9Å; S143-L147 VanDerWaalsContact O-CB 3.27Å; S143-L147 WeakPolarHBondContact O-CB 3.42Å; S143-L147 PolarHBondContact O-N 3.43Å; L147-I151 HydrophobicContact CD1-CD1 3.76Å; L147-I151 HydrophobicContact CD1-CG1 4.16Å; L147-I151 HydrophobicContact CG-CD1 3.87Å; L147-I151 VanDerWaalsContact O-CB 3.3Å; L147-I151 WeakPolarHBondContact O-CB 3.38Å; L147-I151 WeakPolarHBondContact O-CD1 3.15Å; L147-I151 WeakPolarHBondContact O-CG1 3.36Å; L147-I151 PolarHBondContact O-N 3.04Å
148	K	72.5	Confident	70.7	Confident	65 Å²	65	65.3 Å²	65.3	28%	0.283	34%	0.343	S	S	.	.	H	α-helix	trans	-59.8	-50.8	171.5	175.4	-168.4	169.3	-153.7	0	111.2	D144 E146 I151 L152 D174	D144-K148 WeakPolarHBondContact O-CB 3.43Å; D144-K148 PolarHBondContact O-N 3.27Å; E146-K148 VanDerWaalsContact C-N 3.33Å; E146-K148 PolarHBondContact O-N 3.29Å; K148-I151 PolarHBondContact O-N 3.1Å; K148-L152 HydrophobicContact CD-CD1 4.3Å; K148-L152 HydrophobicContact CG-CD1 3.54Å; K148-L152 HydrophobicContact CG-CG 4.43Å; K148-L152 WeakPolarHBondContact O-CB 3.44Å; K148-L152 WeakPolarHBondContact O-CD1 3.44Å; K148-L152 WeakPolarHBondContact O-CG 3.4Å; K148-L152 PolarHBondContact O-N 3.31Å; K148-D174 WeakPolarHBondContact CE-OD1 3.17Å; K148-D174 IonicContact NZ-OD1 3.65Å; K148-D174 PolarHBondContact NZ-OD1 2.79Å; K148-D174 IonicContact NZ-OD2 3.01Å; K148-D174 PolarHBondContact NZ-OD2 3.09Å
149	H	72.5	Confident	72.6	Confident	121 Å²	121	64.7 Å²	64.7	56%	0.56	34%	0.343	S	S	*	.	H	α-helix	trans	-63.2	-47.8	-177.9	-163.7	87	0	0	0	111.3	Q145 E146 I151 L152 E153	Q145-H149 WeakPolarHBondContact O-CB 3.26Å; Q145-H149 PolarHBondContact O-N 3.31Å; E146-H149 PolarHBondContact O-N 3.19Å; H149-I151 PolarHBondContact O-N 3.46Å; H149-L152 PolarHBondContact O-N 3.11Å; H149-L152 VanDerWaalsContact O-N 3.17Å; H149-E153 VanDerWaalsContact O-CB 3.28Å; H149-E153 WeakPolarHBondContact O-CB 3.29Å; H149-E153 PolarHBondContact O-N 3.45Å
150	L	78.6	Confident	74.2	Confident	87 Å²	87	62 Å²	62	46%	0.455	33%	0.325	S	S	.	.	H	α-helix	trans	-58.8	-43.5	177	179	62.8	0	0	0	112.2	L142 E146 A154	L142-L150 HydrophobicContact CD1-CD2 3.96Å; E146-L150 VanDerWaalsContact O-CB 3.23Å; E146-L150 WeakPolarHBondContact O-CB 3.37Å; E146-L150 PolarHBondContact O-N 3.14Å; L150-A154 WeakPolarHBondContact O-CB 3.5Å; L150-A154 PolarHBondContact O-N 3.32Å
151	I	73.1	Confident	75.9	Confident	74 Å²	74	60.4 Å²	60.4	38%	0.379	31%	0.313	S	S	.	.	H	α-helix	trans	-64.6	-43.6	175.8	-72.9	170.2	0	0	0	110.8	L147 K148 H149 A155 I323	L147-I151 HydrophobicContact CD1-CD1 3.76Å; L147-I151 HydrophobicContact CD1-CG1 4.16Å; L147-I151 HydrophobicContact CG-CD1 3.87Å; L147-I151 VanDerWaalsContact O-CB 3.3Å; L147-I151 WeakPolarHBondContact O-CB 3.38Å; L147-I151 WeakPolarHBondContact O-CD1 3.15Å; L147-I151 WeakPolarHBondContact O-CG1 3.36Å; L147-I151 PolarHBondContact O-N 3.04Å; K148-I151 PolarHBondContact O-N 3.1Å; H149-I151 PolarHBondContact O-N 3.46Å; I151-A155 WeakPolarHBondContact O-CB 3.31Å; I151-A155 PolarHBondContact O-N 3.39Å; I151-I323 HydrophobicContact CG2-CD1 3.98Å
152	L	68.9	Low	77.2	Confident	9 Å²	9	53 Å²	53	5%	0.047	28%	0.28	C	S	.	.	H	α-helix	trans	-76	-29.3	-176.4	-64.8	170	0	0	0	112.9	K148 H149 G157 L159 S175	K148-L152 HydrophobicContact CD-CD1 4.3Å; K148-L152 HydrophobicContact CG-CD1 3.54Å; K148-L152 HydrophobicContact CG-CG 4.43Å; K148-L152 WeakPolarHBondContact O-CB 3.44Å; K148-L152 WeakPolarHBondContact O-CD1 3.44Å; K148-L152 WeakPolarHBondContact O-CG 3.4Å; K148-L152 PolarHBondContact O-N 3.31Å; H149-L152 PolarHBondContact O-N 3.11Å; H149-L152 VanDerWaalsContact O-N 3.17Å; L152-G157 WeakPolarHBondContact CD2-O 3.42Å; L152-L159 HydrophobicContact CD2-CB 4.21Å; L152-S175 WeakPolarHBondContact CD1-OG 3.48Å
153	E	71.5	Confident	78.4	Confident	81 Å²	81	52.3 Å²	52.3	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-69.2	-58.2	170.5	-175	166.4	-138.7	0	0	110.5	H149 A155 D156 R269	H149-E153 VanDerWaalsContact O-CB 3.28Å; H149-E153 WeakPolarHBondContact O-CB 3.29Å; H149-E153 PolarHBondContact O-N 3.45Å; E153-A155 PolarHBondContact O-N 3.21Å; E153-D156 PolarHBondContact O-N 2.91Å; E153-R269 PolarHBondContact O-NH2 2.95Å
154	A	68.5	Low	79	Confident	83 Å²	83	50.7 Å²	50.7	69%	0.686	27%	0.266	S	S	*	.	H	α-helix	trans	-71.1	-9	-179	0	0	0	0	0	114.5	L150	L150-A154 WeakPolarHBondContact O-CB 3.5Å; L150-A154 PolarHBondContact O-N 3.32Å
155	A	66.2	Low	79.7	Confident	5 Å²	5	52.5 Å²	52.5	4%	0.041	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-13.9	174	0	0	0	0	0	114.5	I151 E153 G157 I323 R325	I151-A155 WeakPolarHBondContact O-CB 3.31Å; I151-A155 PolarHBondContact O-N 3.39Å; E153-A155 PolarHBondContact O-N 3.21Å; A155-G157 PolarHBondContact O-N 2.71Å; A155-I323 HydrophobicContact CB-CG2 4.24Å; A155-R325 WeakPolarHBondContact O-CD 3.45Å; A155-R325 WeakPolarHBondContact O-CG 3.47Å; A155-R325 PolarHBondContact O-NE 3Å
156	D	70.3	Confident	80.5	Confident	68 Å²	68	48.1 Å²	48.1	36%	0.364	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	44.9	-167.7	-76.3	-61.2	0	0	0	112.8	E153 R269 L326	E153-D156 PolarHBondContact O-N 2.91Å; D156-R269 IonicContact OD1-CZ 2.69Å; D156-R269 IonicContact OD1-NE 3.18Å; D156-R269 PolarHBondContact OD1-NE 2.88Å; D156-R269 IonicContact OD1-NH2 3.51Å; D156-R269 PolarHBondContact OD1-NH2 2.87Å; D156-L326 PolarHBondContact O-N 2.76Å
157	G	83.6	Confident	81.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	-174.8	-168	0	0	0	0	0	115.9	L152 A155 G324	L152-G157 WeakPolarHBondContact CD2-O 3.42Å; A155-G157 PolarHBondContact O-N 2.71Å; G157-G324 CarbonylContact C-O 3.59Å; G157-G324 WeakPolarHBondContact CA-O 3.37Å
158	F	88.6	Confident	81.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	146.2	-179.1	70.5	-82.1	0	0	0	111.3	F160 V172 V176 V179 L180 W187 M250 V289 I323 G324	F158-F160 HydrophobicContact CD2-CB 4.49Å; F158-F160 HydrophobicContact CD2-CD1 4.05Å; F158-F160 HydrophobicContact CE2-CB 4.31Å; F158-F160 AromaticContact CE2-CD1 3.56Å; F158-F160 HydrophobicContact CE2-CD1 3.56Å; F158-F160 HydrophobicContact CE2-CE1 4.25Å; F158-F160 HydrophobicContact CE2-CG 4.25Å; F158-F160 HydrophobicContact CZ-CD1 4.17Å; F158-F160 HydrophobicContact CZ-CE1 4.43Å; F158-V172 HydrophobicContact CD2-CG2 3.96Å; F158-V172 HydrophobicContact CE2-CG2 4.33Å; F158-V176 HydrophobicContact CB-CB 4.34Å; F158-V176 HydrophobicContact CD2-CB 4.01Å; F158-V176 HydrophobicContact CD2-CG2 3.97Å; F158-V176 HydrophobicContact CE2-CG2 4.03Å; F158-V176 HydrophobicContact CG-CB 4.2Å; F158-V176 HydrophobicContact CG-CG2 4.33Å; F158-V176 HydrophobicContact CZ-CG2 4.44Å; F158-V179 HydrophobicContact CD1-CB 4.26Å; F158-V179 HydrophobicContact CD1-CG1 3.99Å; F158-V179 HydrophobicContact CE1-CG1 4.38Å; F158-L180 HydrophobicContact CE1-CD1 3.76Å; F158-L180 HydrophobicContact CE1-CG 4.09Å; F158-L180 HydrophobicContact CZ-CD1 3.7Å; F158-L180 HydrophobicContact CZ-CG 4.5Å; F158-W187 HydrophobicContact CE2-CE3 4.35Å; F158-W187 AromaticContact CE2-CH2 3.98Å; F158-W187 HydrophobicContact CE2-CH2 3.98Å; F158-W187 AromaticContact CE2-CZ3 3.78Å; F158-W187 HydrophobicContact CE2-CZ3 3.78Å; F158-W187 AromaticContact CZ-CH2 3.88Å; F158-W187 HydrophobicContact CZ-CH2 3.88Å; F158-W187 HydrophobicContact CZ-CZ2 4.5Å; F158-W187 HydrophobicContact CZ-CZ3 4.16Å; F158-M250 HydrophobicContact CE1-SD 4.16Å; F158-M250 HydrophobicContact CZ-CE 4.36Å; F158-M250 HydrophobicContact CZ-SD 3.69Å; F158-V289 HydrophobicContact CE1-CG1 4.42Å; F158-I323 CarbonylContact O-C 3.52Å; F158-I323 WeakPolarHBondContact O-CA 3.44Å; F158-G324 WeakPolarHBondContact CD1-O 3.2Å; F158-G324 PolarHBondContact N-O 3.5Å; F158-G324 PolarHBondContact O-N 2.87Å
159	L	90.3	Very high	82.9	Confident	52 Å²	52	46.1 Å²	46.1	27%	0.272	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134.3	177.9	178.9	70.4	0	0	0	109.6	L152 Y171 V172 S173 V321 I323	L152-L159 HydrophobicContact CD2-CB 4.21Å; L159-Y171 HydrophobicContact CD2-CE1 4.04Å; L159-Y171 HydrophobicContact CG-CE1 4.25Å; L159-V172 CarbonylContact O-C 3.58Å; L159-V172 WeakPolarHBondContact O-CA 3.48Å; L159-S173 PolarHBondContact N-OG 2.88Å; L159-S173 PolarHBondContact O-N 2.82Å; L159-S173 PolarHBondContact O-OG 2.72Å; L159-V321 HydrophobicContact CD1-CG1 4.32Å; L159-I323 HydrophobicContact CD1-CG1 3.8Å
160	F	92.8	Very high	83.8	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	158.3	173.2	66.5	-90.1	0	0	0	112.4	F158 V162 Y171 V172 L192 M250 C291 A322	F158-F160 HydrophobicContact CD2-CB 4.49Å; F158-F160 HydrophobicContact CD2-CD1 4.05Å; F158-F160 HydrophobicContact CE2-CB 4.31Å; F158-F160 AromaticContact CE2-CD1 3.56Å; F158-F160 HydrophobicContact CE2-CD1 3.56Å; F158-F160 HydrophobicContact CE2-CE1 4.25Å; F158-F160 HydrophobicContact CE2-CG 4.25Å; F158-F160 HydrophobicContact CZ-CD1 4.17Å; F158-F160 HydrophobicContact CZ-CE1 4.43Å; F160-V162 HydrophobicContact CD2-CG1 4.04Å; F160-V162 HydrophobicContact CD2-CG2 4.45Å; F160-V162 HydrophobicContact CE2-CG1 4.45Å; F160-V162 HydrophobicContact CE2-CG2 4.31Å; F160-Y171 CarbonylContact C-O 3.58Å; F160-Y171 WeakPolarHBondContact CA-O 3.3Å; F160-V172 HydrophobicContact CB-CB 4.37Å; F160-V172 HydrophobicContact CB-CG2 4.32Å; F160-L192 HydrophobicContact CE2-CD2 3.97Å; F160-M250 HydrophobicContact CE1-CE 4.35Å; F160-M250 HydrophobicContact CZ-CE 4.33Å; F160-C291 HydrophobicContact CZ-CB 4.31Å; F160-A322 HydrophobicContact CE1-CB 4.06Å; F160-A322 HydrophobicContact CE2-CB 3.95Å; F160-A322 HydrophobicContact CZ-CB 3.71Å; F160-A322 PolarHBondContact N-O 3.06Å; F160-A322 PolarHBondContact O-N 2.8Å; F160-A322 VanDerWaalsContact O-O 3.12Å
161	V	92.9	Very high	84.4	Confident	26 Å²	26	44 Å²	44	16%	0.158	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.2	174.9	-173.7	0	0	0	0	108.8	V170 Y171 C319 L320 V321	V161-V170 PolarHBondContact O-N 3.21Å; V161-Y171 HydrophobicContact CG2-CD1 4.2Å; V161-Y171 PolarHBondContact N-O 3.15Å; V161-Y171 PolarHBondContact O-N 3.12Å; V161-C319 HydrophobicContact CG1-CB 3.81Å; V161-L320 VanDerWaalsContact CA-O 3.27Å; V161-L320 WeakPolarHBondContact CA-O 3.39Å; V161-V321 HydrophobicContact CG1-CG2 4.13Å; V161-V321 HydrophobicContact CG2-CB 4.48Å; V161-V321 HydrophobicContact CG2-CG1 4.27Å; V161-V321 HydrophobicContact CG2-CG2 4.11Å
162	V	93.4	Very high	85.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.5	179.8	-70.4	0	0	0	0	111.5	F160 R168 V169 L192 L208 C319 L320	F160-V162 HydrophobicContact CD2-CG1 4.04Å; F160-V162 HydrophobicContact CD2-CG2 4.45Å; F160-V162 HydrophobicContact CE2-CG1 4.45Å; F160-V162 HydrophobicContact CE2-CG2 4.31Å; V162-R168 CarbonylContact C-O 3.56Å; V162-R168 VanDerWaalsContact CA-O 3.3Å; V162-R168 WeakPolarHBondContact CA-O 3.46Å; V162-V169 HydrophobicContact CG1-CB 4.21Å; V162-V169 HydrophobicContact CG1-CG2 3.73Å; V162-L192 HydrophobicContact CG1-CB 3.94Å; V162-L192 HydrophobicContact CG1-CD2 4.02Å; V162-L192 HydrophobicContact CG1-CG 4.44Å; V162-L192 HydrophobicContact CG2-CD2 4.09Å; V162-L208 HydrophobicContact CG2-CD2 3.89Å; V162-C319 CarbonylContact O-C 3.58Å; V162-C319 WeakPolarHBondContact O-CA 3.24Å; V162-C319 WeakPolarHBondContact O-CB 3.17Å; V162-L320 HydrophobicContact CG2-CB 3.89Å; V162-L320 HydrophobicContact CG2-CD2 4.22Å; V162-L320 HydrophobicContact CG2-CG 4.41Å; V162-L320 PolarHBondContact N-O 3.29Å; V162-L320 PolarHBondContact O-N 2.84Å
163	S	91.3	Very high	86.3	Confident	11 Å²	11	40 Å²	40	8%	0.077	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	127.5	170.6	173	0	0	0	0	110.3	E165 T166 G167 R168	S163-E165 VanDerWaalsContact C-N 3.25Å; S163-E165 PolarHBondContact O-N 3.37Å; S163-T166 VanDerWaalsContact CB-OG1 3.29Å; S163-T166 WeakPolarHBondContact CB-OG1 3.43Å; S163-T166 PolarHBondContact OG-OG1 3.25Å; S163-G167 VanDerWaalsContact O-CA 3.26Å; S163-G167 WeakPolarHBondContact O-CA 3.41Å; S163-G167 PolarHBondContact O-N 3.34Å; S163-R168 PolarHBondContact N-O 2.77Å
164	C	88.8	Confident	86.9	Confident	15 Å²	15	39.7 Å²	39.7	10%	0.101	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-26.9	179.1	-65.2	0	0	0	0	113.3	L208 T210 Y318	C164-L208 WeakPolarHBondContact CB-O 3.44Å; C164-T210 HydrophobicContact CB-CG2 3.98Å; C164-Y318 WeakPolarHBondContact CB-O 3.22Å; C164-Y318 PolarHBondContact N-O 3.45Å; C164-Y318 VanDerWaalsContact SG-C 3.6Å; C164-Y318 PolarHBondContact SG-O 3.33Å
165	E	85.9	Confident	87.6	Confident	121 Å²	121	36.9 Å²	36.9	57%	0.565	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-35.4	-175.4	-168.6	-171.9	115.9	0	0	112.6	S163 R317	S163-E165 VanDerWaalsContact C-N 3.25Å; S163-E165 PolarHBondContact O-N 3.37Å; E165-R317 IonicContact OE1-CZ 2.75Å; E165-R317 IonicContact OE1-NH1 2.72Å; E165-R317 PolarHBondContact OE1-NH1 3.22Å; E165-R317 IonicContact OE2-CZ 3.9Å; E165-R317 IonicContact OE2-NH1 3.64Å; E165-R317 PolarHBondContact OE2-NH1 3.4Å
166	T	88	Confident	88.6	Confident	68 Å²	68	36.7 Å²	36.7	42%	0.417	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-13.1	-172.6	56.1	0	0	0	0	114	S163 R168	S163-T166 VanDerWaalsContact CB-OG1 3.29Å; S163-T166 WeakPolarHBondContact CB-OG1 3.43Å; S163-T166 PolarHBondContact OG-OG1 3.25Å; T166-R168 PolarHBondContact O-N 2.88Å; T166-R168 VanDerWaalsContact OG1-CB 3.29Å; T166-R168 WeakPolarHBondContact OG1-CB 3.43Å; T166-R168 PolarHBondContact OG1-N 3.32Å
167	G	89.6	Confident	89.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.			trans	70.6	-1.1	-167.1	0	0	0	0	0	114.3	S163 V169 L192	S163-G167 VanDerWaalsContact O-CA 3.26Å; S163-G167 WeakPolarHBondContact O-CA 3.41Å; S163-G167 PolarHBondContact O-N 3.34Å; G167-V169 PolarHBondContact O-N 3.45Å; G167-L192 WeakPolarHBondContact O-CB 3.44Å; G167-L192 PolarHBondContact O-N 2.91Å
168	R	92.8	Very high	89.2	Confident	146 Å²	146	37.2 Å²	37.2	55%	0.551	19%	0.192	S	C	*	.	B	Isolated β-bridge	trans	-65.4	129.4	-173.7	-166.1	-178.8	-171	-157.8	0.4	111.7	V162 S163 T166 V170 G189 S190	V162-R168 CarbonylContact C-O 3.56Å; V162-R168 VanDerWaalsContact CA-O 3.3Å; V162-R168 WeakPolarHBondContact CA-O 3.46Å; S163-R168 PolarHBondContact N-O 2.77Å; T166-R168 PolarHBondContact O-N 2.88Å; T166-R168 VanDerWaalsContact OG1-CB 3.29Å; T166-R168 WeakPolarHBondContact OG1-CB 3.43Å; T166-R168 PolarHBondContact OG1-N 3.32Å; R168-V170 PolarHBondContact O-N 3.29Å; R168-G189 WeakPolarHBondContact CG-O 3.43Å; R168-G189 PolarHBondContact NE-O 2.85Å; R168-S190 CarbonylContact C-O 3.52Å; R168-S190 WeakPolarHBondContact CA-O 3.36Å
169	V	93.6	Very high	88.8	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	114.9	175.4	-179.5	0	0	0	0	109.5	V162 G167 V172 W187 G189 S190 L192	V162-V169 HydrophobicContact CG1-CB 4.21Å; V162-V169 HydrophobicContact CG1-CG2 3.73Å; G167-V169 PolarHBondContact O-N 3.45Å; V169-V172 HydrophobicContact CG1-CB 4.22Å; V169-V172 HydrophobicContact CG1-CG1 4.38Å; V169-W187 WeakPolarHBondContact CB-O 3.5Å; V169-W187 WeakPolarHBondContact CG1-O 3.36Å; V169-W187 HydrophobicContact CG2-CE3 4.19Å; V169-G189 WeakPolarHBondContact O-CA 3.36Å; V169-G189 PolarHBondContact O-N 3.46Å; V169-S190 PolarHBondContact N-O 3.2Å; V169-L192 HydrophobicContact CG2-CB 4.46Å
170	V	91.8	Very high	88.5	Confident	76 Å²	76	34.9 Å²	34.9	46%	0.461	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-34.5	177.6	-177	0	0	0	0	110.8	V161 R168	V161-V170 PolarHBondContact O-N 3.21Å; R168-V170 PolarHBondContact O-N 3.29Å
171	Y	91.3	Very high	88.1	Confident	86 Å²	86	36.5 Å²	36.5	34%	0.337	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	148	177.4	173.2	-89.1	0	0	0	110.5	L159 F160 V161	L159-Y171 HydrophobicContact CD2-CE1 4.04Å; L159-Y171 HydrophobicContact CG-CE1 4.25Å; F160-Y171 CarbonylContact C-O 3.58Å; F160-Y171 WeakPolarHBondContact CA-O 3.3Å; V161-Y171 HydrophobicContact CG2-CD1 4.2Å; V161-Y171 PolarHBondContact N-O 3.15Å; V161-Y171 PolarHBondContact O-N 3.12Å
172	V	91.8	Very high	87.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	144.1	167.2	58.3	0	0	0	0	109.1	F158 L159 F160 V169 V176 Q184 W187 L188	F158-V172 HydrophobicContact CD2-CG2 3.96Å; F158-V172 HydrophobicContact CE2-CG2 4.33Å; L159-V172 CarbonylContact O-C 3.58Å; L159-V172 WeakPolarHBondContact O-CA 3.48Å; F160-V172 HydrophobicContact CB-CB 4.37Å; F160-V172 HydrophobicContact CB-CG2 4.32Å; V169-V172 HydrophobicContact CG1-CB 4.22Å; V169-V172 HydrophobicContact CG1-CG1 4.38Å; V172-V176 HydrophobicContact CG2-CB 3.74Å; V172-V176 HydrophobicContact CG2-CG1 3.89Å; V172-V176 HydrophobicContact CG2-CG2 4.13Å; V172-Q184 HydrophobicContact CG1-CG 3.77Å; V172-Q184 PolarHBondContact O-NE2 3.46Å; V172-W187 HydrophobicContact CB-CB 4.44Å; V172-W187 HydrophobicContact CG1-CB 3.7Å; V172-W187 HydrophobicContact CG2-CE3 4.22Å; V172-L188 HydrophobicContact CG1-CD2 4.05Å; V172-L188 HydrophobicContact CG1-CG 3.95Å
173	S	88.6	Confident	87.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.			trans	-76.5	141.9	174.3	59.6	0	0	0	0	111.7	L159 S175 V176	L159-S173 PolarHBondContact N-OG 2.88Å; L159-S173 PolarHBondContact O-N 2.82Å; L159-S173 PolarHBondContact O-OG 2.72Å; S173-S175 PolarHBondContact O-N 2.81Å; S173-V176 WeakPolarHBondContact O-CB 3.49Å; S173-V176 WeakPolarHBondContact O-CG1 3.22Å; S173-V176 PolarHBondContact O-N 2.7Å
174	D	85.6	Confident	87.6	Confident	74 Å²	74	39.8 Å²	39.8	40%	0.396	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-33.8	-35.6	159.3	47.6	3.8	0	0	0	116.1	K148 V176 T177 P178	K148-D174 WeakPolarHBondContact CE-OD1 3.17Å; K148-D174 IonicContact NZ-OD1 3.65Å; K148-D174 PolarHBondContact NZ-OD1 2.79Å; K148-D174 IonicContact NZ-OD2 3.01Å; K148-D174 PolarHBondContact NZ-OD2 3.09Å; D174-V176 PolarHBondContact O-N 2.86Å; D174-T177 PolarHBondContact O-N 3.03Å; D174-T177 PolarHBondContact O-OG1 2.9Å; D174-P178 WeakPolarHBondContact O-CD 3.41Å
175	S	83.8	Confident	87.7	Confident	25 Å²	25	43.6 Å²	43.6	18%	0.175	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-8.6	172.9	-62.9	0	0	0	0	115.5	L152 S173 T177 P178 V179	L152-S175 WeakPolarHBondContact CD1-OG 3.48Å; S173-S175 PolarHBondContact O-N 2.81Å; S175-T177 VanDerWaalsContact C-N 3.26Å; S175-T177 PolarHBondContact O-N 3.3Å; S175-P178 WeakPolarHBondContact O-CD 3.21Å; S175-P178 WeakPolarHBondContact O-CG 3.33Å; S175-V179 VanDerWaalsContact O-CG2 3.27Å; S175-V179 WeakPolarHBondContact O-CG2 3.2Å; S175-V179 PolarHBondContact O-N 2.84Å
176	V	87	Confident	87.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-33.6	168.4	72.1	0	0	0	0	111.8	F158 V172 S173 D174 V179 L180 W187	F158-V176 HydrophobicContact CB-CB 4.34Å; F158-V176 HydrophobicContact CD2-CB 4.01Å; F158-V176 HydrophobicContact CD2-CG2 3.97Å; F158-V176 HydrophobicContact CE2-CG2 4.03Å; F158-V176 HydrophobicContact CG-CB 4.2Å; F158-V176 HydrophobicContact CG-CG2 4.33Å; F158-V176 HydrophobicContact CZ-CG2 4.44Å; V172-V176 HydrophobicContact CG2-CB 3.74Å; V172-V176 HydrophobicContact CG2-CG1 3.89Å; V172-V176 HydrophobicContact CG2-CG2 4.13Å; S173-V176 WeakPolarHBondContact O-CB 3.49Å; S173-V176 WeakPolarHBondContact O-CG1 3.22Å; S173-V176 PolarHBondContact O-N 2.7Å; D174-V176 PolarHBondContact O-N 2.86Å; V176-V179 PolarHBondContact O-N 2.76Å; V176-L180 HydrophobicContact CG2-CB 4.36Å; V176-L180 HydrophobicContact CG2-CD1 4.1Å; V176-L180 HydrophobicContact CG2-CG 4.44Å; V176-L180 PolarHBondContact O-N 3.45Å; V176-W187 HydrophobicContact CG2-CD2 4.18Å; V176-W187 HydrophobicContact CG2-CG 4.41Å
177	T	85.8	Confident	88	Confident	36 Å²	36	38.4 Å²	38.4	22%	0.221	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-54.9	179.7	-47.4	0	0	0	0	112.2	D174 S175 V179 N181 Q182	D174-T177 PolarHBondContact O-N 3.03Å; D174-T177 PolarHBondContact O-OG1 2.9Å; S175-T177 VanDerWaalsContact C-N 3.26Å; S175-T177 PolarHBondContact O-N 3.3Å; T177-V179 VanDerWaalsContact C-N 3.26Å; T177-V179 PolarHBondContact O-N 2.84Å; T177-N181 WeakPolarHBondContact O-CA 3.32Å; T177-N181 PolarHBondContact O-N 2.88Å; T177-Q182 WeakPolarHBondContact CA-O 3.5Å; T177-Q182 PolarHBondContact OG1-O 2.8Å
178	P	78.9	Confident	88.2	Confident	44 Å²	44	42 Å²	42	29%	0.286	22%	0.221	S	C	.	.	H	α-helix	trans	-73.5	-4.2	177.2	30.2	-38.3	0	0	0	115.6	D174 S175	D174-P178 WeakPolarHBondContact O-CD 3.41Å; S175-P178 WeakPolarHBondContact O-CD 3.21Å; S175-P178 WeakPolarHBondContact O-CG 3.33Å
179	V	80.4	Confident	87.9	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-103.3	-45.1	177.1	177.2	0	0	0	0	111.9	F158 S175 V176 T177 R273 L326	F158-V179 HydrophobicContact CD1-CB 4.26Å; F158-V179 HydrophobicContact CD1-CG1 3.99Å; F158-V179 HydrophobicContact CE1-CG1 4.38Å; S175-V179 VanDerWaalsContact O-CG2 3.27Å; S175-V179 WeakPolarHBondContact O-CG2 3.2Å; S175-V179 PolarHBondContact O-N 2.84Å; V176-V179 PolarHBondContact O-N 2.76Å; T177-V179 VanDerWaalsContact C-N 3.26Å; T177-V179 PolarHBondContact O-N 2.84Å; V179-R273 PolarHBondContact O-NE 2.92Å; V179-L326 HydrophobicContact CG1-CB 4.35Å
180	L	84.5	Confident	87.8	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-113.5	-4.8	-175.3	-62	-175.1	0	0	0	114.5	F158 V176 Q182 W187 M250 C252 G253 R273 V287 V289	F158-L180 HydrophobicContact CE1-CD1 3.76Å; F158-L180 HydrophobicContact CE1-CG 4.09Å; F158-L180 HydrophobicContact CZ-CD1 3.7Å; F158-L180 HydrophobicContact CZ-CG 4.5Å; V176-L180 HydrophobicContact CG2-CB 4.36Å; V176-L180 HydrophobicContact CG2-CD1 4.1Å; V176-L180 HydrophobicContact CG2-CG 4.44Å; V176-L180 PolarHBondContact O-N 3.45Å; L180-Q182 PolarHBondContact O-N 3.22Å; L180-W187 HydrophobicContact CD1-CH2 4.1Å; L180-W187 HydrophobicContact CD1-CZ2 3.53Å; L180-M250 HydrophobicContact CD1-CB 4.18Å; L180-M250 HydrophobicContact CD1-SD 4.1Å; L180-M250 HydrophobicContact CD2-CB 4.3Å; L180-C252 CarbonylContact O-C 3.53Å; L180-C252 WeakPolarHBondContact O-CA 3.45Å; L180-G253 PolarHBondContact O-N 3.14Å; L180-R273 PolarHBondContact O-NH2 2.85Å; L180-V287 HydrophobicContact CD2-CG2 3.6Å; L180-V289 HydrophobicContact CD2-CG2 4.26Å
181	N	84.8	Confident	87.9	Confident	34 Å²	34	35.2 Å²	35.2	18%	0.182	20%	0.204	C	C	.	.	S	Bend	trans	52.2	32.9	-170.1	-65.5	25.6	0	0	0	113.2	T177 G253 T254 C255 R273	T177-N181 WeakPolarHBondContact O-CA 3.32Å; T177-N181 PolarHBondContact O-N 2.88Å; N181-G253 VanDerWaalsContact CB-O 3.3Å; N181-G253 WeakPolarHBondContact CB-O 3.38Å; N181-G253 CarbonylContact O-C 3.59Å; N181-G253 WeakPolarHBondContact O-CA 3.18Å; N181-T254 PolarHBondContact O-N 3.31Å; N181-C255 WeakPolarHBondContact O-CB 3.47Å; N181-C255 PolarHBondContact O-N 3.03Å; N181-R273 PolarHBondContact ND2-NH1 2.86Å; N181-R273 VanDerWaalsContact ND2-NH1 3.19Å; N181-R273 PolarHBondContact OD1-NH1 2.92Å
182	Q	87.1	Confident	88.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.188	C	C	.	.			trans	-107.7	149.1	171	-73.5	-159.5	49.8	0	0	110.5	T177 L180 W187 Q195 R251	T177-Q182 WeakPolarHBondContact CA-O 3.5Å; T177-Q182 PolarHBondContact OG1-O 2.8Å; L180-Q182 PolarHBondContact O-N 3.22Å; Q182-W187 VanDerWaalsContact OE1-CD1 3.23Å; Q182-Q195 VanDerWaalsContact CD-OE1 3.32Å; Q182-Q195 VanDerWaalsContact OE1-CD 3.31Å; Q182-R251 PolarHBondContact NE2-O 3.36Å
183	S	88.9	Confident	88.2	Confident	31 Å²	31	34 Å²	34	22%	0.217	20%	0.199	C	C	.	.			trans	-78	147.3	178.4	72.3	0	0	0	0	111.2	S185 E186 W187	S183-S185 WeakPolarHBondContact CB-OG 3.37Å; S183-S185 PolarHBondContact O-N 3.13Å; S183-S185 PolarHBondContact OG-OG 2.99Å; S183-E186 PolarHBondContact N-OE2 3.02Å; S183-E186 WeakPolarHBondContact O-CB 3.39Å; S183-E186 PolarHBondContact O-N 2.89Å; S183-E186 WeakPolarHBondContact OG-CB 3.41Å; S183-E186 PolarHBondContact OG-N 3Å; S183-E186 VanDerWaalsContact OG-N 3.14Å; S183-W187 PolarHBondContact O-N 2.77Å
184	Q	90.6	Very high	88.3	Confident	74 Å²	74	39.1 Å²	39.1	35%	0.346	23%	0.227	S	C	.	.	H	α-helix	trans	-57.2	-35.5	175.3	-158.2	-168.1	6.1	0	0	111.4	V172 E186 W187 L188	V172-Q184 HydrophobicContact CG1-CG 3.77Å; V172-Q184 PolarHBondContact O-NE2 3.46Å; Q184-E186 PolarHBondContact O-N 3.26Å; Q184-W187 PolarHBondContact O-N 2.94Å; Q184-L188 HydrophobicContact CG-CD1 4Å; Q184-L188 HydrophobicContact CG-CG 4.36Å; Q184-L188 WeakPolarHBondContact O-CB 3.29Å; Q184-L188 VanDerWaalsContact O-CG 3.24Å; Q184-L188 WeakPolarHBondContact O-CG 3.41Å; Q184-L188 PolarHBondContact O-N 2.95Å
185	S	91.2	Very high	88.6	Confident	96 Å²	96	36 Å²	36	67%	0.671	21%	0.21	S	C	*	.	H	α-helix	trans	-67.6	-24.3	175.6	38.9	0	0	0	0	115.3	S183	S183-S185 WeakPolarHBondContact CB-OG 3.37Å; S183-S185 PolarHBondContact O-N 3.13Å; S183-S185 PolarHBondContact OG-OG 2.99Å
186	E	89.1	Confident	89.1	Confident	79 Å²	79	35 Å²	35	37%	0.369	20%	0.203	S	C	.	.	H	α-helix	trans	-82.6	-27.4	177.2	177.6	177.9	-162.7	0	0	111.6	S183 Q184 S190	S183-E186 PolarHBondContact N-OE2 3.02Å; S183-E186 WeakPolarHBondContact O-CB 3.39Å; S183-E186 PolarHBondContact O-N 2.89Å; S183-E186 WeakPolarHBondContact OG-CB 3.41Å; S183-E186 PolarHBondContact OG-N 3Å; S183-E186 VanDerWaalsContact OG-N 3.14Å; Q184-E186 PolarHBondContact O-N 3.26Å; E186-S190 WeakPolarHBondContact O-CB 3.3Å; E186-S190 PolarHBondContact O-OG 2.86Å
187	W	91.9	Very high	89.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-86.1	-40.2	173.1	-86.5	58.2	0	0	0	113.1	F158 V169 V172 V176 L180 Q182 S183 Q184 G189 S190 L192 Q195 M250	F158-W187 HydrophobicContact CE2-CE3 4.35Å; F158-W187 AromaticContact CE2-CH2 3.98Å; F158-W187 HydrophobicContact CE2-CH2 3.98Å; F158-W187 AromaticContact CE2-CZ3 3.78Å; F158-W187 HydrophobicContact CE2-CZ3 3.78Å; F158-W187 AromaticContact CZ-CH2 3.88Å; F158-W187 HydrophobicContact CZ-CH2 3.88Å; F158-W187 HydrophobicContact CZ-CZ2 4.5Å; F158-W187 HydrophobicContact CZ-CZ3 4.16Å; V169-W187 WeakPolarHBondContact CB-O 3.5Å; V169-W187 WeakPolarHBondContact CG1-O 3.36Å; V169-W187 HydrophobicContact CG2-CE3 4.19Å; V172-W187 HydrophobicContact CB-CB 4.44Å; V172-W187 HydrophobicContact CG1-CB 3.7Å; V172-W187 HydrophobicContact CG2-CE3 4.22Å; V176-W187 HydrophobicContact CG2-CD2 4.18Å; V176-W187 HydrophobicContact CG2-CG 4.41Å; L180-W187 HydrophobicContact CD1-CH2 4.1Å; L180-W187 HydrophobicContact CD1-CZ2 3.53Å; Q182-W187 VanDerWaalsContact OE1-CD1 3.23Å; S183-W187 PolarHBondContact O-N 2.77Å; Q184-W187 PolarHBondContact O-N 2.94Å; W187-G189 PolarHBondContact O-N 2.89Å; W187-G189 VanDerWaalsContact O-N 3.14Å; W187-S190 PolarHBondContact O-N 3.31Å; W187-S190 PolarHBondContact O-OG 3.26Å; W187-L192 HydrophobicContact CH2-CD1 3.86Å; W187-L192 HydrophobicContact CZ3-CD1 3.71Å; W187-Q195 HydrophobicContact CD2-CG 4.3Å; W187-Q195 HydrophobicContact CH2-CB 4.08Å; W187-Q195 HydrophobicContact CH2-CG 4.43Å; W187-Q195 HydrophobicContact CZ2-CB 3.72Å; W187-Q195 HydrophobicContact CZ2-CG 3.9Å; W187-M250 HydrophobicContact CH2-CE 4.2Å; W187-M250 HydrophobicContact CH2-SD 3.98Å
188	L	92.2	Very high	89.5	Confident	76 Å²	76	39.1 Å²	39.1	40%	0.398	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	118	-175.5	-78.1	170.6	0	0	0	111.7	V172 Q184 S190	V172-L188 HydrophobicContact CG1-CD2 4.05Å; V172-L188 HydrophobicContact CG1-CG 3.95Å; Q184-L188 HydrophobicContact CG-CD1 4Å; Q184-L188 HydrophobicContact CG-CG 4.36Å; Q184-L188 WeakPolarHBondContact O-CB 3.29Å; Q184-L188 VanDerWaalsContact O-CG 3.24Å; Q184-L188 WeakPolarHBondContact O-CG 3.41Å; Q184-L188 PolarHBondContact O-N 2.95Å; L188-S190 VanDerWaalsContact C-N 3.29Å; L188-S190 PolarHBondContact O-N 2.9Å
189	G	87.6	Confident	90.1	Very high	30 Å²	30	41.7 Å²	41.7	31%	0.309	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-5.6	178.8	0	0	0	0	0	115.7	R168 V169 W187	R168-G189 WeakPolarHBondContact CG-O 3.43Å; R168-G189 PolarHBondContact NE-O 2.85Å; V169-G189 WeakPolarHBondContact O-CA 3.36Å; V169-G189 PolarHBondContact O-N 3.46Å; W187-G189 PolarHBondContact O-N 2.89Å; W187-G189 VanDerWaalsContact O-N 3.14Å
190	S	92	Very high	90.8	Very high	28 Å²	28	41.9 Å²	41.9	20%	0.196	24%	0.238	C	C	.	.	S	Bend	trans	-76.2	173.1	171	85.6	0	0	0	0	111.4	R168 V169 E186 W187 L188	R168-S190 CarbonylContact C-O 3.52Å; R168-S190 WeakPolarHBondContact CA-O 3.36Å; V169-S190 PolarHBondContact N-O 3.2Å; E186-S190 WeakPolarHBondContact O-CB 3.3Å; E186-S190 PolarHBondContact O-OG 2.86Å; W187-S190 PolarHBondContact O-N 3.31Å; W187-S190 PolarHBondContact O-OG 3.26Å; L188-S190 VanDerWaalsContact C-N 3.29Å; L188-S190 PolarHBondContact O-N 2.9Å
191	S	93.7	Very high	91.2	Very high	24 Å²	24	44.1 Å²	44.1	17%	0.168	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-84.6	142	169.4	-157.7	0	0	0	0	111	Y193 D194	S191-Y193 PolarHBondContact O-N 3.22Å; S191-Y193 WeakPolarHBondContact OG-CD2 3.41Å; S191-D194 WeakPolarHBondContact CB-OD2 3.31Å; S191-D194 PolarHBondContact N-OD2 2.94Å; S191-D194 VanDerWaalsContact N-OD2 3.14Å; S191-D194 PolarHBondContact O-N 3.38Å
192	L	94.1	Very high	91.4	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	26%	0.263	C	S	.	.	S	Bend	trans	-65.2	-28.5	170	-176.7	62	0	0	0	111.3	F160 V162 G167 V169 W187 D194 Q195 L196 L204 M250	F160-L192 HydrophobicContact CE2-CD2 3.97Å; V162-L192 HydrophobicContact CG1-CB 3.94Å; V162-L192 HydrophobicContact CG1-CD2 4.02Å; V162-L192 HydrophobicContact CG1-CG 4.44Å; V162-L192 HydrophobicContact CG2-CD2 4.09Å; G167-L192 WeakPolarHBondContact O-CB 3.44Å; G167-L192 PolarHBondContact O-N 2.91Å; V169-L192 HydrophobicContact CG2-CB 4.46Å; W187-L192 HydrophobicContact CH2-CD1 3.86Å; W187-L192 HydrophobicContact CZ3-CD1 3.71Å; L192-D194 VanDerWaalsContact C-N 3.28Å; L192-D194 PolarHBondContact O-N 2.92Å; L192-Q195 PolarHBondContact O-N 3.3Å; L192-Q195 VanDerWaalsContact O-N 3.11Å; L192-L196 PolarHBondContact O-N 2.86Å; L192-L204 HydrophobicContact CB-CD2 4.19Å; L192-L204 HydrophobicContact CD2-CD1 3.89Å; L192-L204 HydrophobicContact CD2-CD2 3.59Å; L192-L204 HydrophobicContact CD2-CG 4.4Å; L192-L204 HydrophobicContact CG-CD2 3.71Å; L192-M250 HydrophobicContact CD1-CE 4.22Å
193	Y	93.9	Very high	91.6	Very high	59 Å²	59	52 Å²	52	23%	0.231	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-62.2	-34.6	176.2	-62	-69.6	0	0	0	112.3	S191 Q195 L196 T201 L204 R205	S191-Y193 PolarHBondContact O-N 3.22Å; S191-Y193 WeakPolarHBondContact OG-CD2 3.41Å; Y193-Q195 PolarHBondContact O-N 2.92Å; Y193-L196 PolarHBondContact O-N 3.44Å; Y193-T201 HydrophobicContact CD1-CG2 4.27Å; Y193-L204 HydrophobicContact CD1-CD2 3.75Å; Y193-L204 HydrophobicContact CD1-CG 4.45Å; Y193-L204 HydrophobicContact CE1-CB 4.16Å; Y193-L204 HydrophobicContact CE1-CD2 3.7Å; Y193-L204 HydrophobicContact CE1-CG 3.95Å; Y193-L204 HydrophobicContact CG-CD2 4.45Å; Y193-R205 HydrophobicContact CE1-CB 4.26Å
194	D	91.9	Very high	91.7	Very high	107 Å²	107	50.6 Å²	50.6	57%	0.572	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-68.4	-21.4	177.1	-47.8	-34.1	0	0	0	112.3	S191 L192	S191-D194 WeakPolarHBondContact CB-OD2 3.31Å; S191-D194 PolarHBondContact N-OD2 2.94Å; S191-D194 VanDerWaalsContact N-OD2 3.14Å; S191-D194 PolarHBondContact O-N 3.38Å; L192-D194 VanDerWaalsContact C-N 3.28Å; L192-D194 PolarHBondContact O-N 2.92Å
195	Q	92	Very high	91.7	Very high	8 Å²	8	54 Å²	54	4%	0.037	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-96.5	-4.8	-177.9	-59.3	-65.8	2.9	0	0	113.2	Q182 W187 L192 Y193 M250 R251	Q182-Q195 VanDerWaalsContact CD-OE1 3.32Å; Q182-Q195 VanDerWaalsContact OE1-CD 3.31Å; W187-Q195 HydrophobicContact CD2-CG 4.3Å; W187-Q195 HydrophobicContact CH2-CB 4.08Å; W187-Q195 HydrophobicContact CH2-CG 4.43Å; W187-Q195 HydrophobicContact CZ2-CB 3.72Å; W187-Q195 HydrophobicContact CZ2-CG 3.9Å; L192-Q195 PolarHBondContact O-N 3.3Å; L192-Q195 VanDerWaalsContact O-N 3.11Å; Y193-Q195 PolarHBondContact O-N 2.92Å; Q195-M250 WeakPolarHBondContact O-CA 3.37Å; Q195-R251 PolarHBondContact O-N 3.02Å
196	L	92.7	Very high	91.5	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.026	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-99.1	160.9	175.8	-69.2	-163.1	0	0	0	112.9	L192 Y193 D200 L204 C248 R249 M250	L192-L196 PolarHBondContact O-N 2.86Å; Y193-L196 PolarHBondContact O-N 3.44Å; L196-D200 HydrophobicContact CD1-CB 4.49Å; L196-L204 HydrophobicContact CD1-CB 3.73Å; L196-L204 HydrophobicContact CD1-CD2 3.54Å; L196-L204 HydrophobicContact CD1-CG 4.15Å; L196-L204 HydrophobicContact CG-CD2 4.31Å; L196-C248 HydrophobicContact CD1-CB 4.23Å; L196-C248 HydrophobicContact CD2-CB 3.99Å; L196-R249 CarbonylContact C-O 3.52Å; L196-R249 WeakPolarHBondContact CA-O 3.34Å; L196-M250 HydrophobicContact CD2-CE 4.19Å; L196-M250 HydrophobicContact CD2-CG 3.65Å
197	H	91.1	Very high	91.5	Very high	44 Å²	44	54 Å²	54	20%	0.204	28%	0.276	C	S	.	.			trans	-67.2	136.8	163.9	-168.9	-73.2	0	0	0	110.5	D199 D200 R249 Y286	H197-D199 VanDerWaalsContact CE1-CG 3.46Å; H197-D199 IonicContact CE1-OD1 2.99Å; H197-D199 PolarHBondContact CE1-OD1 3.07Å; H197-D199 IonicContact CE1-OD2 3.76Å; H197-D199 PolarHBondContact CE1-OD2 3.49Å; H197-D199 VanDerWaalsContact CE1-OD2 3.23Å; H197-D199 IonicContact ND1-OD1 2.64Å; H197-D199 PolarHBondContact ND1-OD1 2.99Å; H197-D199 IonicContact ND1-OD2 3.24Å; H197-D199 PolarHBondContact ND1-OD2 3.06Å; H197-D199 PolarHBondContact O-N 2.84Å; H197-D200 PolarHBondContact O-N 3.05Å; H197-R249 HydrophobicContact CB-CB 3.57Å; H197-R249 PolarHBondContact CE1-NH1 2.9Å; H197-R249 PolarHBondContact N-O 3.49Å; H197-R249 PolarHBondContact ND1-NH1 3.32Å; H197-R249 VanDerWaalsContact ND1-NH1 3.16Å; H197-R249 PolarHBondContact NE2-NH1 3.04Å; H197-Y286 HydrophobicContact CB-CD1 3.92Å; H197-Y286 HydrophobicContact CB-CE1 3.9Å; H197-Y286 HydrophobicContact CB-CG 4.38Å; H197-Y286 AromaticContact CD2-CD2 3.69Å; H197-Y286 AromaticContact CD2-CE2 3.71Å
198	P	90.8	Very high	91.2	Very high	79 Å²	79	54.1 Å²	54.1	51%	0.513	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-46.8	-52.2	-175.2	-33.7	36.9	0	0	0	115.8	D200 T201	P198-D200 PolarHBondContact O-N 3.11Å; P198-D200 VanDerWaalsContact O-N 3.1Å; P198-T201 WeakPolarHBondContact O-CB 3.42Å; P198-T201 WeakPolarHBondContact O-CG2 3.22Å; P198-T201 PolarHBondContact O-N 2.98Å; P198-T201 VanDerWaalsContact O-N 3.07Å; P198-T201 PolarHBondContact O-OG1 3.23Å
199	D	92.8	Very high	90.7	Very high	98 Å²	98	52.7 Å²	52.7	52%	0.524	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-68.2	-3	179.5	19.3	-62.8	0	0	0	116.2	H197 R249	H197-D199 VanDerWaalsContact CE1-CG 3.46Å; H197-D199 IonicContact CE1-OD1 2.99Å; H197-D199 PolarHBondContact CE1-OD1 3.07Å; H197-D199 IonicContact CE1-OD2 3.76Å; H197-D199 PolarHBondContact CE1-OD2 3.49Å; H197-D199 VanDerWaalsContact CE1-OD2 3.23Å; H197-D199 IonicContact ND1-OD1 2.64Å; H197-D199 PolarHBondContact ND1-OD1 2.99Å; H197-D199 IonicContact ND1-OD2 3.24Å; H197-D199 PolarHBondContact ND1-OD2 3.06Å; H197-D199 PolarHBondContact O-N 2.84Å; D199-R249 IonicContact OD2-CZ 3.08Å; D199-R249 IonicContact OD2-NH1 2.69Å; D199-R249 PolarHBondContact OD2-NH1 2.8Å; D199-R249 IonicContact OD2-NH2 3.27Å; D199-R249 PolarHBondContact OD2-NH2 3.03Å
200	D	93.6	Very high	89.7	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.032	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-98.7	-8.7	170.6	-66.9	-18.8	0	0	0	113.3	L196 H197 P198 E202 K203 L204 C248 R249	L196-D200 HydrophobicContact CD1-CB 4.49Å; H197-D200 PolarHBondContact O-N 3.05Å; P198-D200 PolarHBondContact O-N 3.11Å; P198-D200 VanDerWaalsContact O-N 3.1Å; D200-E202 PolarHBondContact O-N 2.96Å; D200-K203 PolarHBondContact O-N 2.88Å; D200-K203 IonicContact OD1-NZ 3.62Å; D200-K203 PolarHBondContact OD1-NZ 3.07Å; D200-L204 PolarHBondContact O-N 3.06Å; D200-L204 VanDerWaalsContact O-N 3.07Å; D200-C248 HydrophobicContact CB-CB 4.35Å; D200-R249 IonicContact OD1-CZ 3.35Å; D200-R249 IonicContact OD1-NE 2.73Å; D200-R249 IonicContact OD1-NH2 3.23Å; D200-R249 PolarHBondContact OD1-NH2 3.38Å; D200-R249 WeakPolarHBondContact OD2-CB 3.28Å; D200-R249 IonicContact OD2-CZ 3.2Å; D200-R249 PolarHBondContact OD2-N 3.47Å; D200-R249 IonicContact OD2-NE 2.85Å; D200-R249 PolarHBondContact OD2-NE 3.14Å; D200-R249 IonicContact OD2-NH2 3.64Å; D200-R249 PolarHBondContact OD2-NH2 2.96Å
201	T	92.6	Very high	88	Confident	48 Å²	48	58 Å²	58	29%	0.294	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-42.3	-177.3	56.5	0	0	0	0	113.4	Y193 P198 L204 R205	Y193-T201 HydrophobicContact CD1-CG2 4.27Å; P198-T201 WeakPolarHBondContact O-CB 3.42Å; P198-T201 WeakPolarHBondContact O-CG2 3.22Å; P198-T201 PolarHBondContact O-N 2.98Å; P198-T201 VanDerWaalsContact O-N 3.07Å; P198-T201 PolarHBondContact O-OG1 3.23Å; T201-L204 PolarHBondContact O-N 2.98Å; T201-R205 PolarHBondContact O-N 2.82Å
202	E	90.7	Very high	86.1	Confident	89 Å²	89	61.7 Å²	61.7	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-42.1	177.7	-172.3	61.8	-110.4	0	0	111.6	D200 L204 R205 E206	D200-E202 PolarHBondContact O-N 2.96Å; E202-L204 VanDerWaalsContact C-N 3.31Å; E202-L204 PolarHBondContact O-N 3.21Å; E202-R205 WeakPolarHBondContact O-CA 3.02Å; E202-R205 WeakPolarHBondContact O-CB 3.14Å; E202-R205 PolarHBondContact O-N 2.83Å; E202-R205 IonicContact OE1-CZ 3.14Å; E202-R205 IonicContact OE1-NE 3.1Å; E202-R205 PolarHBondContact OE1-NE 3.21Å; E202-R205 IonicContact OE1-NH2 2.72Å; E202-R205 PolarHBondContact OE1-NH2 3Å; E202-R205 IonicContact OE2-CZ 3.44Å; E202-R205 IonicContact OE2-NE 2.67Å; E202-R205 IonicContact OE2-NH2 2.85Å; E202-R205 PolarHBondContact OE2-NH2 2.86Å; E202-E206 PolarHBondContact O-N 3.43Å
203	K	90.1	Very high	83.8	Confident	110 Å²	110	67.2 Å²	67.2	48%	0.478	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-39.8	176.2	-53.7	171.8	-165.9	159.6	0	111.2	D200 R205 Q207	D200-K203 PolarHBondContact O-N 2.88Å; D200-K203 IonicContact OD1-NZ 3.62Å; D200-K203 PolarHBondContact OD1-NZ 3.07Å; K203-R205 VanDerWaalsContact C-N 3.34Å; K203-Q207 VanDerWaalsContact O-CG 3.29Å; K203-Q207 WeakPolarHBondContact O-CG 3.48Å; K203-Q207 PolarHBondContact O-N 2.88Å; K203-Q207 VanDerWaalsContact O-N 3.13Å
204	L	90.9	Very high	81.5	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-64	-40.5	172.9	176.7	66.6	0	0	0	111.2	L192 Y193 L196 D200 T201 E202 E206 Q207 L208 F246	L192-L204 HydrophobicContact CB-CD2 4.19Å; L192-L204 HydrophobicContact CD2-CD1 3.89Å; L192-L204 HydrophobicContact CD2-CD2 3.59Å; L192-L204 HydrophobicContact CD2-CG 4.4Å; L192-L204 HydrophobicContact CG-CD2 3.71Å; Y193-L204 HydrophobicContact CD1-CD2 3.75Å; Y193-L204 HydrophobicContact CD1-CG 4.45Å; Y193-L204 HydrophobicContact CE1-CB 4.16Å; Y193-L204 HydrophobicContact CE1-CD2 3.7Å; Y193-L204 HydrophobicContact CE1-CG 3.95Å; Y193-L204 HydrophobicContact CG-CD2 4.45Å; L196-L204 HydrophobicContact CD1-CB 3.73Å; L196-L204 HydrophobicContact CD1-CD2 3.54Å; L196-L204 HydrophobicContact CD1-CG 4.15Å; L196-L204 HydrophobicContact CG-CD2 4.31Å; D200-L204 PolarHBondContact O-N 3.06Å; D200-L204 VanDerWaalsContact O-N 3.07Å; T201-L204 PolarHBondContact O-N 2.98Å; E202-L204 VanDerWaalsContact C-N 3.31Å; E202-L204 PolarHBondContact O-N 3.21Å; L204-E206 VanDerWaalsContact C-N 3.34Å; L204-E206 PolarHBondContact O-N 3.44Å; L204-Q207 CarbonylContact O-C 3.54Å; L204-Q207 PolarHBondContact O-N 3.41Å; L204-Q207 VanDerWaalsContact O-N 3.12Å; L204-L208 HydrophobicContact CD1-CD1 4.02Å; L204-L208 HydrophobicContact CD1-CD2 4.46Å; L204-L208 HydrophobicContact CD1-CG 3.9Å; L204-L208 HydrophobicContact CD2-CD1 4.2Å; L204-L208 HydrophobicContact CG-CD1 3.86Å; L204-L208 HydrophobicContact CG-CG 4.14Å; L204-L208 WeakPolarHBondContact O-CG 3.37Å; L204-L208 PolarHBondContact O-N 3.22Å; L204-F246 HydrophobicContact CD1-CE1 4.34Å; L204-F246 HydrophobicContact CD1-CE2 3.84Å; L204-F246 HydrophobicContact CD1-CZ 3.6Å
205	R	90.4	Very high	79.2	Confident	144 Å²	144	71.4 Å²	71.4	54%	0.543	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-42	178.4	-169	173.3	71.7	156.4	-0	111.9	Y193 T201 E202 K203 L208 S209	Y193-R205 HydrophobicContact CE1-CB 4.26Å; T201-R205 PolarHBondContact O-N 2.82Å; E202-R205 WeakPolarHBondContact O-CA 3.02Å; E202-R205 WeakPolarHBondContact O-CB 3.14Å; E202-R205 PolarHBondContact O-N 2.83Å; E202-R205 IonicContact OE1-CZ 3.14Å; E202-R205 IonicContact OE1-NE 3.1Å; E202-R205 PolarHBondContact OE1-NE 3.21Å; E202-R205 IonicContact OE1-NH2 2.72Å; E202-R205 PolarHBondContact OE1-NH2 3Å; E202-R205 IonicContact OE2-CZ 3.44Å; E202-R205 IonicContact OE2-NE 2.67Å; E202-R205 IonicContact OE2-NH2 2.85Å; E202-R205 PolarHBondContact OE2-NH2 2.86Å; K203-R205 VanDerWaalsContact C-N 3.34Å; R205-L208 PolarHBondContact O-N 3.35Å; R205-S209 PolarHBondContact O-N 3.39Å; R205-S209 VanDerWaalsContact O-N 3.12Å
206	E	88.2	Confident	77	Confident	122 Å²	122	77 Å²	77	57%	0.57	41%	0.407	S	S	*	.	H	α-helix	trans	-59.8	-45.2	171.3	-67.7	177.3	164.5	0	0	111.7	E202 L204 S209	E202-E206 PolarHBondContact O-N 3.43Å; L204-E206 VanDerWaalsContact C-N 3.34Å; L204-E206 PolarHBondContact O-N 3.44Å; E206-S209 VanDerWaalsContact O-CB 3.31Å; E206-S209 WeakPolarHBondContact O-CB 3.45Å; E206-S209 PolarHBondContact O-N 2.92Å; E206-S209 PolarHBondContact O-OG 3.11Å
207	Q	87.8	Confident	74.7	Confident	55 Å²	55	80.4 Å²	80.4	26%	0.257	44%	0.443	S	S	.	.	H	α-helix	trans	-68.4	-34.7	179.5	-67.3	-68.9	-49.6	0	0	113.6	K203 L204 S209 R244 F246	K203-Q207 VanDerWaalsContact O-CG 3.29Å; K203-Q207 WeakPolarHBondContact O-CG 3.48Å; K203-Q207 PolarHBondContact O-N 2.88Å; K203-Q207 VanDerWaalsContact O-N 3.13Å; L204-Q207 CarbonylContact O-C 3.54Å; L204-Q207 PolarHBondContact O-N 3.41Å; L204-Q207 VanDerWaalsContact O-N 3.12Å; Q207-S209 VanDerWaalsContact C-N 3.26Å; Q207-R244 WeakPolarHBondContact O-CD 3.37Å; Q207-R244 PolarHBondContact O-NE 2.91Å; Q207-F246 HydrophobicContact CB-CD1 3.84Å; Q207-F246 HydrophobicContact CB-CE1 4.11Å; Q207-F246 HydrophobicContact CB-CG 4.46Å; Q207-F246 HydrophobicContact CG-CB 3.9Å; Q207-F246 HydrophobicContact CG-CD1 3.69Å; Q207-F246 HydrophobicContact CG-CE1 4.45Å; Q207-F246 HydrophobicContact CG-CG 3.94Å
208	L	86.1	Confident	72.6	Confident	2 Å²	2	86.4 Å²	86.4	1%	0.01	46%	0.464	C	S	.	.	H	α-helix	trans	-76.4	-13.8	174.9	-69.7	179.6	0	0	0	112.7	V162 C164 L204 R205 T210 L320	V162-L208 HydrophobicContact CG2-CD2 3.89Å; C164-L208 WeakPolarHBondContact CB-O 3.44Å; L204-L208 HydrophobicContact CD1-CD1 4.02Å; L204-L208 HydrophobicContact CD1-CD2 4.46Å; L204-L208 HydrophobicContact CD1-CG 3.9Å; L204-L208 HydrophobicContact CD2-CD1 4.2Å; L204-L208 HydrophobicContact CG-CD1 3.86Å; L204-L208 HydrophobicContact CG-CG 4.14Å; L204-L208 WeakPolarHBondContact O-CG 3.37Å; L204-L208 PolarHBondContact O-N 3.22Å; R205-L208 PolarHBondContact O-N 3.35Å; L208-T210 PolarHBondContact O-N 2.81Å; L208-L320 HydrophobicContact CD2-CB 3.76Å; L208-L320 HydrophobicContact CD2-CD2 3.71Å; L208-L320 HydrophobicContact CD2-CG 4.38Å
209	S	81.3	Confident	70.4	Confident	45 Å²	45	91 Å²	91	32%	0.315	48%	0.481	S	S	.	.			trans	-60	129	176.6	78.2	0	0	0	0	111.7	R205 E206 Q207 S211 R244	R205-S209 PolarHBondContact O-N 3.39Å; R205-S209 VanDerWaalsContact O-N 3.12Å; E206-S209 VanDerWaalsContact O-CB 3.31Å; E206-S209 WeakPolarHBondContact O-CB 3.45Å; E206-S209 PolarHBondContact O-N 2.92Å; E206-S209 PolarHBondContact O-OG 3.11Å; Q207-S209 VanDerWaalsContact C-N 3.26Å; S209-S211 VanDerWaalsContact C-N 3.3Å; S209-R244 PolarHBondContact O-NH2 2.88Å
210	T	67.3	Low	68.6	Low	75 Å²	75	91 Å²	91	46%	0.46	48%	0.48	S	S	.	.			trans	-88.6	-1.1	177.5	52.6	0	0	0	0	112.4	C164 L208 E212 I295 Y318	C164-T210 HydrophobicContact CB-CG2 3.98Å; L208-T210 PolarHBondContact O-N 2.81Å; T210-E212 PolarHBondContact O-N 3Å; T210-I295 HydrophobicContact CG2-CG2 4.49Å; T210-Y318 HydrophobicContact CG2-CD2 3.73Å; T210-Y318 HydrophobicContact CG2-CG 3.71Å
211	S	56.6	Low	66.6	Low	95 Å²	95	93.8 Å²	93.8	66%	0.664	50%	0.495	S	S	*	.			trans	-75.1	59	178.2	50.6	0	0	0	0	112.5	S209	S209-S211 VanDerWaalsContact C-N 3.3Å
212	E	52.3	Low	64.9	Low	102 Å²	102	99.4 Å²	99.4	48%	0.477	52%	0.523	S	S	.	.			trans	-64.7	145.3	153.9	-75.4	-149.7	100.5	0	0	109.7	T210 N214 G241	T210-E212 PolarHBondContact O-N 3Å; E212-N214 PolarHBondContact O-N 3.15Å; E212-G241 VanDerWaalsContact CD-C 3.43Å; E212-G241 VanDerWaalsContact CD-O 3.25Å; E212-G241 WeakPolarHBondContact OE1-CA 3.37Å; E212-G241 VanDerWaalsContact OE2-CA 3.32Å; E212-G241 WeakPolarHBondContact OE2-CA 3.32Å
213	N	47	Very low	63	Low	117 Å²	117	104 Å²	104	63%	0.626	54%	0.541	S	S	*	.			trans	-68.6	119.9	-170.8	-172.3	4	0	0	0	111.4	N215 T216	N213-N215 PolarHBondContact O-N 3.29Å; N213-T216 PolarHBondContact O-N 2.75Å
214	N	44.5	Very low	61.5	Low	156 Å²	156	102.3 Å²	102.3	83%	0.834	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	8.6	-177.2	-110.6	-23.3	0	0	0	115.7	E212	E212-N214 PolarHBondContact O-N 3.15Å
215	N	43.7	Very low	59.5	Low	98 Å²	98	104.6 Å²	104.6	52%	0.524	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.9	-19.5	-177.4	-105.4	-7.1	0	0	0	114.5	N213 G217 R218	N213-N215 PolarHBondContact O-N 3.29Å; N215-G217 VanDerWaalsContact C-N 3.28Å; N215-G217 PolarHBondContact O-N 2.86Å; N215-R218 PolarHBondContact O-N 3.45Å
216	T	46.4	Very low	57.9	Low	126 Å²	126	102.1 Å²	102.1	77%	0.773	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-24.1	-178.9	49.8	0	0	0	0	113.3	N213 R218	N213-T216 PolarHBondContact O-N 2.75Å; T216-R218 PolarHBondContact O-N 2.88Å
217	G	44.3	Very low	55.8	Low	76 Å²	76	100.9 Å²	100.9	78%	0.784	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	2	172.8	0	0	0	0	0	115.2	N215	N215-G217 VanDerWaalsContact C-N 3.28Å; N215-G217 PolarHBondContact O-N 2.86Å
218	R	47.3	Very low	53.8	Low	170 Å²	170	107.4 Å²	107.4	64%	0.642	59%	0.593	S	S	*	*			trans	-110.1	62.1	177.4	-64.6	-175.7	-176.5	178.7	2.5	111.3	N215 T216 L220	N215-R218 PolarHBondContact O-N 3.45Å; T216-R218 PolarHBondContact O-N 2.88Å; R218-L220 PolarHBondContact O-N 3.06Å
219	M	44.9	Very low	51.9	Low	176 Å²	176	116.7 Å²	116.7	87%	0.867	63%	0.633	S	S	*	*			trans	-66.9	106.4	167.7	-158.5	-173.5	-51.2	0	0	108.5	D221	M219-D221 PolarHBondContact O-N 2.87Å
220	L	55.5	Low	49.8	Very low	98 Å²	98	122 Å²	122	51%	0.513	65%	0.653	S	S	.	*			trans	-75.1	112.7	176.5	-165.2	85.9	0	0	0	108.2	R218 L222 V227	R218-L220 PolarHBondContact O-N 3.06Å; L220-L222 PolarHBondContact O-N 3.4Å; L220-V227 HydrophobicContact CD1-CG2 4.08Å
221	D	50.1	Low	48.4	Very low	64 Å²	64	123.4 Å²	123.4	34%	0.342	67%	0.666	S	S	.	*			trans	-64.3	105.2	171.5	171.9	16.6	0	0	0	109.2	M219 K223 T224 G225	M219-D221 PolarHBondContact O-N 2.87Å; D221-K223 PolarHBondContact O-N 2.86Å; D221-K223 WeakPolarHBondContact OD1-CG 3.47Å; D221-K223 PolarHBondContact OD1-N 2.81Å; D221-T224 PolarHBondContact O-N 3.32Å; D221-T224 WeakPolarHBondContact OD2-CB 3.42Å; D221-T224 VanDerWaalsContact OD2-CG2 3.28Å; D221-T224 WeakPolarHBondContact OD2-CG2 3.44Å; D221-T224 PolarHBondContact OD2-OG1 2.97Å; D221-G225 PolarHBondContact O-N 3.4Å
222	L	57.7	Low	48	Very low	166 Å²	166	127.9 Å²	127.9	87%	0.869	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-11.7	-174.7	-161.5	63.7	0	0	0	113	L220	L220-L222 PolarHBondContact O-N 3.4Å
223	K	50.9	Low	47.4	Very low	185 Å²	185	132 Å²	132	80%	0.804	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-13.2	174.1	99.3	-173.2	-177.1	179.5	0	114.5	D221	D221-K223 PolarHBondContact O-N 2.86Å; D221-K223 WeakPolarHBondContact OD1-CG 3.47Å; D221-K223 PolarHBondContact OD1-N 2.81Å
224	T	58.2	Low	47	Very low	75 Å²	75	130.6 Å²	130.6	46%	0.46	70%	0.695	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.2	-16.2	179.7	65.4	0	0	0	0	115.5	D221 T226	D221-T224 PolarHBondContact O-N 3.32Å; D221-T224 WeakPolarHBondContact OD2-CB 3.42Å; D221-T224 VanDerWaalsContact OD2-CG2 3.28Å; D221-T224 WeakPolarHBondContact OD2-CG2 3.44Å; D221-T224 PolarHBondContact OD2-OG1 2.97Å; T224-T226 PolarHBondContact O-N 3.01Å; T224-T226 VanDerWaalsContact O-N 3.07Å
225	G	49.8	Very low	46.9	Very low	49 Å²	49	128.6 Å²	128.6	51%	0.505	69%	0.694	S	S	.	*			trans	66.3	5.4	175.8	0	0	0	0	0	116	D221	D221-G225 PolarHBondContact O-N 3.4Å
226	T	55.4	Low	46.7	Very low	92 Å²	92	128.5 Å²	128.5	56%	0.564	71%	0.706	S	S	*	*			trans	-101.3	130.9	-176.1	56.2	0	0	0	0	112.4	T224 K228	T224-T226 PolarHBondContact O-N 3.01Å; T224-T226 VanDerWaalsContact O-N 3.07Å; T226-K228 PolarHBondContact O-N 2.87Å
227	V	45.4	Very low	46.7	Very low	97 Å²	97	133.8 Å²	133.8	59%	0.588	71%	0.712	S	S	*	*			trans	-80.2	87.5	176.6	-176.7	0	0	0	0	109.3	L220 K229	L220-V227 HydrophobicContact CD1-CG2 4.08Å; V227-K229 PolarHBondContact O-N 2.72Å
228	K	44.6	Very low	46.9	Very low	192 Å²	192	136.3 Å²	136.3	84%	0.835	71%	0.705	S	S	*	*			trans	-74.5	105.5	174.6	-168.5	177.6	-176.2	-177	0	109.8	T226 E230	T226-K228 PolarHBondContact O-N 2.87Å; K228-E230 PolarHBondContact O-N 3.29Å; K228-E230 VanDerWaalsContact O-N 3.08Å
229	K	47.4	Very low	47.1	Very low	197 Å²	197	133 Å²	133	86%	0.857	70%	0.704	S	S	*	*			trans	-62.2	108.6	170.3	-178	-178.2	178.9	-176.5	0	108.9	V227 S231	V227-K229 PolarHBondContact O-N 2.72Å; K229-S231 PolarHBondContact O-N 2.21Å
230	E	37.4	Very low	47.4	Very low	155 Å²	155	133.1 Å²	133.1	72%	0.724	70%	0.704	S	S	*	*			trans	-64.2	133	174.4	-168.1	169.1	-157.7	0	0	109.8	K228	K228-E230 PolarHBondContact O-N 3.29Å; K228-E230 VanDerWaalsContact O-N 3.08Å
231	S	37.2	Very low	47.6	Very low	106 Å²	106	129.7 Å²	129.7	74%	0.741	69%	0.693	S	S	*	*			trans	-80.4	147	178.9	-166.3	0	0	0	0	110.1	K229 Q233	K229-S231 PolarHBondContact O-N 2.21Å; S231-Q233 PolarHBondContact O-N 2.76Å
232	Q	47.7	Very low	48.8	Very low	189 Å²	189	127.6 Å²	127.6	88%	0.883	68%	0.684	S	S	*	*	S	Bend	trans	-67.1	90.3	-175.8	-71.4	-162.9	-24.7	0	0	112.6
233	Q	40.6	Very low	50.2	Low	189 Å²	189	127.8 Å²	127.8	88%	0.883	67%	0.673	S	S	*	*			trans	-154.4	19.6	163.1	-119.7	163	5.3	0	0	115.2	S231 S235	S231-Q233 PolarHBondContact O-N 2.76Å; Q233-S235 PolarHBondContact O-N 3.41Å
234	S	38.3	Very low	52	Low	87 Å²	87	120.4 Å²	120.4	61%	0.608	64%	0.64	S	S	*	*			trans	-85.3	105.5	164.2	36.6	0	0	0	0	110.1
235	S	42.3	Very low	53.5	Low	114 Å²	114	119.3 Å²	119.3	80%	0.797	64%	0.635	S	S	*	*			trans	-53.8	146.1	173.1	179.8	0	0	0	0	111	Q233 R237	Q233-S235 PolarHBondContact O-N 3.41Å; S235-R237 PolarHBondContact O-N 2.86Å
236	A	40.1	Very low	55.5	Low	95 Å²	95	118 Å²	118	79%	0.785	62%	0.616	S	S	*	*			trans	-69.7	64.7	-168.7	0	0	0	0	0	113.9	M238	A236-M238 VanDerWaalsContact C-N 3.25Å; A236-M238 PolarHBondContact O-N 3.18Å
237	R	45.8	Very low	57.3	Low	238 Å²	238	117.9 Å²	117.9	90%	0.898	61%	0.611	S	S	*	*			trans	-70.6	82.5	172.8	-171.3	-175	-65.3	-158.4	1	108.9	S235 T239	S235-R237 PolarHBondContact O-N 2.86Å; R237-T239 PolarHBondContact O-N 3.08Å; R237-T239 VanDerWaalsContact O-N 3.12Å
238	M	48.8	Very low	59.5	Low	129 Å²	129	113.5 Å²	113.5	64%	0.635	59%	0.585	S	S	*	*			trans	3	87.4	177.4	-52.7	-169.5	84.4	0	0	114.7	A236 Y294	A236-M238 VanDerWaalsContact C-N 3.25Å; A236-M238 PolarHBondContact O-N 3.18Å; M238-Y294 HydrophobicContact CE-CD1 3.47Å; M238-Y294 VanDerWaalsContact CE-CD1 3.47Å; M238-Y294 HydrophobicContact CE-CD2 3.53Å; M238-Y294 HydrophobicContact CE-CE1 3.7Å; M238-Y294 HydrophobicContact CE-CE2 3.75Å; M238-Y294 HydrophobicContact CE-CG 3.39Å
239	T	51.8	Low	61.6	Low	101 Å²	101	106.4 Å²	106.4	62%	0.62	55%	0.553	S	S	*	*			trans	-64.1	137.5	175.3	46.6	0	0	0	0	109.9	R237 G241 A242	R237-T239 PolarHBondContact O-N 3.08Å; R237-T239 VanDerWaalsContact O-N 3.12Å; T239-G241 PolarHBondContact O-N 3.03Å; T239-A242 WeakPolarHBondContact O-CB 3.33Å; T239-A242 PolarHBondContact O-N 3.42Å
240	M	51.1	Low	63.7	Low	178 Å²	178	97 Å²	97	88%	0.877	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-60.5	-33.1	-170.9	-167.4	176	-71.2	0	0	113.1	A242 R243	M240-A242 VanDerWaalsContact C-N 3.3Å; M240-A242 PolarHBondContact O-N 3.35Å; M240-R243 WeakPolarHBondContact O-CB 3.45Å; M240-R243 PolarHBondContact O-N 2.65Å
241	G	59.7	Low	66.2	Low	26 Å²	26	94.2 Å²	94.2	27%	0.268	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-66.5	-22.2	175.1	0	0	0	0	0	115.2	E212 T239 R243 R244	E212-G241 VanDerWaalsContact CD-C 3.43Å; E212-G241 VanDerWaalsContact CD-O 3.25Å; E212-G241 WeakPolarHBondContact OE1-CA 3.37Å; E212-G241 VanDerWaalsContact OE2-CA 3.32Å; E212-G241 WeakPolarHBondContact OE2-CA 3.32Å; T239-G241 PolarHBondContact O-N 3.03Å; G241-R243 PolarHBondContact O-N 3.19Å; G241-R244 PolarHBondContact O-NH1 3Å
242	A	75.1	Confident	68.5	Low	19 Å²	19	90 Å²	90	16%	0.157	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-74.2	-9.5	175.8	0	0	0	0	0	113.2	T239 M240 Y294 I295	T239-A242 WeakPolarHBondContact O-CB 3.33Å; T239-A242 PolarHBondContact O-N 3.42Å; M240-A242 VanDerWaalsContact C-N 3.3Å; M240-A242 PolarHBondContact O-N 3.35Å; A242-Y294 CarbonylContact O-C 3.48Å; A242-Y294 VanDerWaalsContact O-CA 3.27Å; A242-Y294 WeakPolarHBondContact O-CA 3.41Å; A242-I295 PolarHBondContact O-N 3.45Å
243	R	86.6	Confident	70.2	Confident	170 Å²	170	81.7 Å²	81.7	64%	0.642	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	147.1	177.1	-166.5	175.1	178	176.1	-2	110.9	M240 G241 G293	M240-R243 WeakPolarHBondContact O-CB 3.45Å; M240-R243 PolarHBondContact O-N 2.65Å; G241-R243 PolarHBondContact O-N 3.19Å; R243-G293 WeakPolarHBondContact CG-O 3.42Å
244	R	88.9	Confident	71.7	Confident	30 Å²	30	79.6 Å²	79.6	11%	0.113	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.2	170.9	-63.8	-65.2	-179	-96.1	4.6	110	Q207 S209 G241 G293 I295 L320	Q207-R244 WeakPolarHBondContact O-CD 3.37Å; Q207-R244 PolarHBondContact O-NE 2.91Å; S209-R244 PolarHBondContact O-NH2 2.88Å; G241-R244 PolarHBondContact O-NH1 3Å; R244-G293 PolarHBondContact N-O 3.02Å; R244-G293 PolarHBondContact O-N 3.28Å; R244-G293 VanDerWaalsContact O-O 3.1Å; R244-I295 HydrophobicContact CG-CD1 3.92Å; R244-I295 HydrophobicContact CG-CG1 4.12Å; R244-L320 HydrophobicContact CB-CD1 3.98Å; R244-L320 HydrophobicContact CG-CD1 4.19Å
245	S	90.6	Very high	73.2	Confident	52 Å²	52	77.3 Å²	77.3	36%	0.364	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	115.4	-179.8	-165.9	0	0	0	0	108.2	H290 C291	S245-H290 WeakPolarHBondContact CB-NE2 3.32Å; S245-H290 PolarHBondContact OG-NE2 3.32Å; S245-C291 WeakPolarHBondContact CA-O 3.39Å
246	F	91.6	Very high	74.1	Confident	21 Å²	21	77.5 Å²	77.5	9%	0.092	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	153.7	-175.8	58.3	-92.7	0	0	0	111.8	L204 Q207 C248 H290 C291 L320	L204-F246 HydrophobicContact CD1-CE1 4.34Å; L204-F246 HydrophobicContact CD1-CE2 3.84Å; L204-F246 HydrophobicContact CD1-CZ 3.6Å; Q207-F246 HydrophobicContact CB-CD1 3.84Å; Q207-F246 HydrophobicContact CB-CE1 4.11Å; Q207-F246 HydrophobicContact CB-CG 4.46Å; Q207-F246 HydrophobicContact CG-CB 3.9Å; Q207-F246 HydrophobicContact CG-CD1 3.69Å; Q207-F246 HydrophobicContact CG-CE1 4.45Å; Q207-F246 HydrophobicContact CG-CG 3.94Å; F246-C248 HydrophobicContact CD2-CB 4.3Å; F246-H290 PolarHBondContact O-CD2 3.41Å; F246-C291 HydrophobicContact CD1-CB 4.37Å; F246-C291 HydrophobicContact CD2-CB 3.92Å; F246-C291 HydrophobicContact CE1-CB 4.01Å; F246-C291 HydrophobicContact CE2-CB 3.51Å; F246-C291 HydrophobicContact CG-CB 4.33Å; F246-C291 HydrophobicContact CZ-CB 3.56Å; F246-C291 PolarHBondContact N-O 3.17Å; F246-C291 PolarHBondContact O-N 3.35Å; F246-L320 HydrophobicContact CE1-CD2 3.89Å; F246-L320 HydrophobicContact CZ-CD2 4.11Å
247	I	91.6	Very high	74.9	Confident	91 Å²	91	74.6 Å²	74.6	47%	0.467	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.1	175	-59.8	168.3	0	0	0	107.7	V288 H290	I247-V288 HydrophobicContact CG2-CG1 3.39Å; I247-H290 HydrophobicContact CG1-CB 4.31Å
248	C	92.1	Very high	75.2	Confident	5 Å²	5	69.9 Å²	69.9	3%	0.034	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	156.3	-179.7	60.4	0	0	0	0	110.9	L196 D200 F246 V289	L196-C248 HydrophobicContact CD1-CB 4.23Å; L196-C248 HydrophobicContact CD2-CB 3.99Å; D200-C248 HydrophobicContact CB-CB 4.35Å; F246-C248 HydrophobicContact CD2-CB 4.3Å; C248-V289 PolarHBondContact N-O 2.8Å; C248-V289 PolarHBondContact O-N 3.33Å
249	R	90.2	Very high	75.3	Confident	42 Å²	42	68.3 Å²	68.3	16%	0.158	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	115.3	174	-71	164.8	-71.9	175.9	-8.7	109.8	L196 H197 D199 D200 L276 Y286 V287	L196-R249 CarbonylContact C-O 3.52Å; L196-R249 WeakPolarHBondContact CA-O 3.34Å; H197-R249 HydrophobicContact CB-CB 3.57Å; H197-R249 PolarHBondContact CE1-NH1 2.9Å; H197-R249 PolarHBondContact N-O 3.49Å; H197-R249 PolarHBondContact ND1-NH1 3.32Å; H197-R249 VanDerWaalsContact ND1-NH1 3.16Å; H197-R249 PolarHBondContact NE2-NH1 3.04Å; D199-R249 IonicContact OD2-CZ 3.08Å; D199-R249 IonicContact OD2-NH1 2.69Å; D199-R249 PolarHBondContact OD2-NH1 2.8Å; D199-R249 IonicContact OD2-NH2 3.27Å; D199-R249 PolarHBondContact OD2-NH2 3.03Å; D200-R249 IonicContact OD1-CZ 3.35Å; D200-R249 IonicContact OD1-NE 2.73Å; D200-R249 IonicContact OD1-NH2 3.23Å; D200-R249 PolarHBondContact OD1-NH2 3.38Å; D200-R249 WeakPolarHBondContact OD2-CB 3.28Å; D200-R249 IonicContact OD2-CZ 3.2Å; D200-R249 PolarHBondContact OD2-N 3.47Å; D200-R249 IonicContact OD2-NE 2.85Å; D200-R249 PolarHBondContact OD2-NE 3.14Å; D200-R249 IonicContact OD2-NH2 3.64Å; D200-R249 PolarHBondContact OD2-NH2 2.96Å; R249-L276 VanDerWaalsContact CD-CD1 3.42Å; R249-L276 HydrophobicContact CG-CD1 3.73Å; R249-Y286 HydrophobicContact CB-CD1 4.43Å; R249-V287 CarbonylContact C-O 3.56Å; R249-V287 WeakPolarHBondContact CA-O 3.45Å
250	M	91.4	Very high	74.9	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	142.2	177.1	-72.8	-177	170.4	0	0	111.7	F158 F160 L180 W187 L192 Q195 L196 Y286 V287 V289 C291	F158-M250 HydrophobicContact CE1-SD 4.16Å; F158-M250 HydrophobicContact CZ-CE 4.36Å; F158-M250 HydrophobicContact CZ-SD 3.69Å; F160-M250 HydrophobicContact CE1-CE 4.35Å; F160-M250 HydrophobicContact CZ-CE 4.33Å; L180-M250 HydrophobicContact CD1-CB 4.18Å; L180-M250 HydrophobicContact CD1-SD 4.1Å; L180-M250 HydrophobicContact CD2-CB 4.3Å; W187-M250 HydrophobicContact CH2-CE 4.2Å; W187-M250 HydrophobicContact CH2-SD 3.98Å; L192-M250 HydrophobicContact CD1-CE 4.22Å; Q195-M250 WeakPolarHBondContact O-CA 3.37Å; L196-M250 HydrophobicContact CD2-CE 4.19Å; L196-M250 HydrophobicContact CD2-CG 3.65Å; M250-Y286 CarbonylContact O-C 3.6Å; M250-Y286 VanDerWaalsContact O-CA 3.31Å; M250-Y286 WeakPolarHBondContact O-CA 3.43Å; M250-V287 PolarHBondContact N-O 3.21Å; M250-V287 PolarHBondContact O-N 2.92Å; M250-V289 HydrophobicContact CB-CB 4.48Å; M250-V289 HydrophobicContact CB-CG2 3.85Å; M250-V289 HydrophobicContact CE-CG1 4.31Å; M250-V289 HydrophobicContact CG-CB 4.08Å; M250-V289 HydrophobicContact CG-CG2 3.97Å; M250-V289 HydrophobicContact SD-CB 3.74Å; M250-V289 HydrophobicContact SD-CG1 3.71Å; M250-V289 HydrophobicContact SD-CG2 3.75Å; M250-C291 VanDerWaalsContact CE-SG 3.54Å
251	R	88.9	Confident	74.8	Confident	97 Å²	97	67.7 Å²	67.7	37%	0.366	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	133.6	-179	-174.4	177.3	176.8	-135.2	-1.7	111.4	Q182 Q195 Y286	Q182-R251 PolarHBondContact NE2-O 3.36Å; Q195-R251 PolarHBondContact O-N 3.02Å; R251-Y286 HydrophobicContact CB-CD1 4.14Å; R251-Y286 HydrophobicContact CB-CE1 3.89Å; R251-Y286 HydrophobicContact CG-CE1 4.46Å
252	C	86.1	Confident	74.3	Confident	17 Å²	17	68.7 Å²	68.7	12%	0.115	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-84.4	137.4	167.2	-71.1	0	0	0	0	110.8	L180 R273 Q285 V287	L180-C252 CarbonylContact O-C 3.53Å; L180-C252 WeakPolarHBondContact O-CA 3.45Å; C252-R273 PolarHBondContact SG-NH2 3.05Å; C252-Q285 HydrophobicContact CB-CB 4.24Å; C252-Q285 HydrophobicContact CB-CG 4.36Å; C252-Q285 PolarHBondContact N-O 2.92Å; C252-V287 VanDerWaalsContact SG-CG1 3.58Å
253	G	82.2	Confident	73.3	Confident	15 Å²	15	72.6 Å²	72.6	16%	0.155	39%	0.388	C	S	.	.			trans	-93.8	-179.7	170.9	0	0	0	0	0	113.2	L180 N181	L180-G253 PolarHBondContact O-N 3.14Å; N181-G253 VanDerWaalsContact CB-O 3.3Å; N181-G253 WeakPolarHBondContact CB-O 3.38Å; N181-G253 CarbonylContact O-C 3.59Å; N181-G253 WeakPolarHBondContact O-CA 3.18Å
254	T	73.4	Confident	71.4	Confident	144 Å²	144	75.3 Å²	75.3	88%	0.883	40%	0.399	S	S	*	.			trans	-106.8	11.1	-178.7	52.8	0	0	0	0	113.3	N181	N181-T254 PolarHBondContact O-N 3.31Å
255	C	70.1	Confident	69.5	Low	40 Å²	40	77.5 Å²	77.5	27%	0.27	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-62.2	124.3	-179.1	-166.9	0	0	0	0	110.5	N181 V257	N181-C255 WeakPolarHBondContact O-CB 3.47Å; N181-C255 PolarHBondContact O-N 3.03Å; C255-V257 PolarHBondContact O-N 2.81Å
256	P	59.4	Low	67.6	Low	118 Å²	118	76 Å²	76	77%	0.766	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-71.6	119.7	179.3	28.4	-33.3	0	0	0	110.2	E258	P256-E258 PolarHBondContact O-N 3.33Å
257	V	58.1	Low	65.5	Low	33 Å²	33	81 Å²	81	20%	0.2	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-82.9	116.2	174.4	-176.3	0	0	0	0	108.6	C255 M262	C255-V257 PolarHBondContact O-N 2.81Å; V257-M262 HydrophobicContact CB-CE 3.84Å; V257-M262 HydrophobicContact CG1-CE 3.63Å
258	E	52.5	Low	63.4	Low	140 Å²	140	81.6 Å²	81.6	65%	0.654	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-66.8	124.5	-175.1	-169.1	167	-135.3	0	0	111.6	P256 M260 S261	P256-E258 PolarHBondContact O-N 3.33Å; E258-M260 PolarHBondContact O-N 3.03Å; E258-S261 PolarHBondContact O-N 2.87Å; E258-S261 PolarHBondContact O-OG 3.27Å
259	P	49.3	Very low	61.6	Low	95 Å²	95	83.1 Å²	83.1	62%	0.617	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-59.1	-26.5	-168.1	-28.2	35.3	0	0	0	115.4	S261 M262	P259-S261 PolarHBondContact O-N 3.21Å; P259-S261 VanDerWaalsContact O-N 3.16Å; P259-M262 PolarHBondContact O-N 3.19Å
260	M	44.3	Very low	59.8	Low	180 Å²	180	84.2 Å²	84.2	89%	0.887	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-69.7	-10.2	-174.8	-57.6	-172.7	-173.4	0	0	113.8	E258	E258-M260 PolarHBondContact O-N 3.03Å
261	S	49.1	Very low	57.7	Low	86 Å²	86	92.3 Å²	92.3	60%	0.601	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-100.6	0.4	176.6	65.6	0	0	0	0	114.3	E258 P259 N263	E258-S261 PolarHBondContact O-N 2.87Å; E258-S261 PolarHBondContact O-OG 3.27Å; P259-S261 PolarHBondContact O-N 3.21Å; P259-S261 VanDerWaalsContact O-N 3.16Å; S261-N263 PolarHBondContact O-N 3.05Å
262	M	48.6	Very low	55.8	Low	48 Å²	48	90.6 Å²	90.6	24%	0.236	48%	0.475	C	S	.	.			trans	-86.7	102	-174.3	-69.3	-158.3	-172.4	0	0	113.6	V257 P259 F267	V257-M262 HydrophobicContact CB-CE 3.84Å; V257-M262 HydrophobicContact CG1-CE 3.63Å; P259-M262 PolarHBondContact O-N 3.19Å; M262-F267 HydrophobicContact CB-CD2 3.84Å; M262-F267 HydrophobicContact CB-CE2 3.58Å; M262-F267 HydrophobicContact CG-CE2 4.28Å; M262-F267 HydrophobicContact SD-CD1 4.47Å; M262-F267 HydrophobicContact SD-CD2 3.92Å; M262-F267 HydrophobicContact SD-CE1 4.36Å; M262-F267 HydrophobicContact SD-CE2 3.8Å; M262-F267 HydrophobicContact SD-CG 4.27Å; M262-F267 HydrophobicContact SD-CZ 4.02Å
263	N	53.6	Low	54.5	Low	100 Å²	100	91.7 Å²	91.7	54%	0.535	48%	0.477	S	S	.	.			trans	-57	157.7	153.6	-84.9	-12.9	0	0	0	110.3	S261 L265 S266	S261-N263 PolarHBondContact O-N 3.05Å; N263-L265 PolarHBondContact O-N 2.84Å; N263-S266 WeakPolarHBondContact O-CB 3.41Å; N263-S266 PolarHBondContact O-N 3.22Å
264	R	47.8	Very low	53.1	Low	227 Å²	227	93.6 Å²	93.6	86%	0.857	48%	0.483	S	S	*	.	H	α-helix	trans	-54.7	-29.9	179.5	-70.9	-171.6	178.7	-162.7	0.9	113.3	S266 F267 L268	R264-S266 VanDerWaalsContact C-N 3.33Å; R264-S266 PolarHBondContact O-N 3.03Å; R264-F267 PolarHBondContact O-N 3.39Å; R264-L268 PolarHBondContact O-N 3.24Å
265	L	49	Very low	52.2	Low	76 Å²	76	87.1 Å²	87.1	40%	0.398	45%	0.446	S	S	.	.	H	α-helix	trans	-58.6	-39.7	171.7	-109.5	70	0	0	0	112.7	N263 F267 L268 R269	N263-L265 PolarHBondContact O-N 2.84Å; L265-F267 VanDerWaalsContact C-N 3.34Å; L265-F267 PolarHBondContact O-N 2.93Å; L265-L268 CarbonylContact O-C 3.57Å; L265-L268 WeakPolarHBondContact O-CB 3.19Å; L265-L268 PolarHBondContact O-N 3.24Å; L265-L268 VanDerWaalsContact O-N 3.14Å; L265-R269 WeakPolarHBondContact O-CG 3.47Å; L265-R269 PolarHBondContact O-N 2.86Å
266	S	50	Low	51.4	Low	21 Å²	21	91.3 Å²	91.3	15%	0.147	46%	0.464	C	S	.	.	H	α-helix	trans	-66	-35.3	-178.7	-56.3	0	0	0	0	112.6	N263 R264 R269 S270	N263-S266 WeakPolarHBondContact O-CB 3.41Å; N263-S266 PolarHBondContact O-N 3.22Å; R264-S266 VanDerWaalsContact C-N 3.33Å; R264-S266 PolarHBondContact O-N 3.03Å; S266-R269 PolarHBondContact O-N 2.8Å; S266-S270 WeakPolarHBondContact O-CB 3.18Å; S266-S270 PolarHBondContact O-N 3.32Å
267	F	48.6	Very low	51.1	Low	127 Å²	127	88.2 Å²	88.2	56%	0.557	45%	0.454	S	S	*	.	H	α-helix	trans	-64.7	-42.3	171	-82.5	-86.5	0	0	0	111.9	M262 R264 L265 S270 R271	M262-F267 HydrophobicContact CB-CD2 3.84Å; M262-F267 HydrophobicContact CB-CE2 3.58Å; M262-F267 HydrophobicContact CG-CE2 4.28Å; M262-F267 HydrophobicContact SD-CD1 4.47Å; M262-F267 HydrophobicContact SD-CD2 3.92Å; M262-F267 HydrophobicContact SD-CE1 4.36Å; M262-F267 HydrophobicContact SD-CE2 3.8Å; M262-F267 HydrophobicContact SD-CG 4.27Å; M262-F267 HydrophobicContact SD-CZ 4.02Å; R264-F267 PolarHBondContact O-N 3.39Å; L265-F267 VanDerWaalsContact C-N 3.34Å; L265-F267 PolarHBondContact O-N 2.93Å; F267-S270 PolarHBondContact O-N 2.91Å; F267-R271 PolarHBondContact O-N 2.93Å
268	L	46.8	Very low	50.9	Low	102 Å²	102	92.1 Å²	92.1	53%	0.534	48%	0.479	S	S	.	.	H	α-helix	trans	-65.7	-43	175	-69.1	168.5	0	0	0	111.8	R264 L265 S270 R271 N272	R264-L268 PolarHBondContact O-N 3.24Å; L265-L268 CarbonylContact O-C 3.57Å; L265-L268 WeakPolarHBondContact O-CB 3.19Å; L265-L268 PolarHBondContact O-N 3.24Å; L265-L268 VanDerWaalsContact O-N 3.14Å; L268-S270 VanDerWaalsContact C-N 3.33Å; L268-S270 PolarHBondContact O-N 3.25Å; L268-R271 PolarHBondContact O-N 2.92Å; L268-N272 WeakPolarHBondContact O-CB 3.05Å; L268-N272 PolarHBondContact O-N 3.14Å; L268-N272 PolarHBondContact O-ND2 2.89Å
269	R	54.1	Low	51.1	Low	38 Å²	38	89.8 Å²	89.8	14%	0.143	48%	0.475	C	S	.	.	H	α-helix	trans	-57.8	-45.3	173.8	-71.5	174.7	-172.8	171.7	3.7	110.8	E153 D156 L265 S266 N272 R273	E153-R269 PolarHBondContact O-NH2 2.95Å; D156-R269 IonicContact OD1-CZ 2.69Å; D156-R269 IonicContact OD1-NE 3.18Å; D156-R269 PolarHBondContact OD1-NE 2.88Å; D156-R269 IonicContact OD1-NH2 3.51Å; D156-R269 PolarHBondContact OD1-NH2 2.87Å; L265-R269 WeakPolarHBondContact O-CG 3.47Å; L265-R269 PolarHBondContact O-N 2.86Å; S266-R269 PolarHBondContact O-N 2.8Å; R269-N272 PolarHBondContact O-N 2.84Å; R269-R273 WeakPolarHBondContact O-CG 3.46Å
270	S	51.9	Low	51.5	Low	65 Å²	65	92.6 Å²	92.6	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-48.2	176.4	-166.7	0	0	0	0	112.4	S266 F267 L268 N272 R273	S266-S270 WeakPolarHBondContact O-CB 3.18Å; S266-S270 PolarHBondContact O-N 3.32Å; F267-S270 PolarHBondContact O-N 2.91Å; L268-S270 VanDerWaalsContact C-N 3.33Å; L268-S270 PolarHBondContact O-N 3.25Å; S270-N272 PolarHBondContact O-N 2.89Å; S270-R273 PolarHBondContact O-N 2.81Å
271	R	47.3	Very low	51.9	Low	169 Å²	169	94 Å²	94	64%	0.638	48%	0.482	S	S	*	.	H	α-helix	trans	-70.6	-10.6	-179.4	-152.6	177.7	-170.7	-175.8	3.7	114.1	F267 L268 D336	F267-R271 PolarHBondContact O-N 2.93Å; L268-R271 PolarHBondContact O-N 2.92Å; R271-D336 IonicContact CZ-OD1 2.92Å; R271-D336 IonicContact NH2-OD1 2.64Å; R271-D336 PolarHBondContact NH2-OD1 3.46Å
272	N	48.8	Very low	52.6	Low	62 Å²	62	93.8 Å²	93.8	33%	0.332	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	8.9	175.7	-77.7	-77.4	0	0	0	113.9	L268 R269 S270 N274 V328	L268-N272 WeakPolarHBondContact O-CB 3.05Å; L268-N272 PolarHBondContact O-N 3.14Å; L268-N272 PolarHBondContact O-ND2 2.89Å; R269-N272 PolarHBondContact O-N 2.84Å; S270-N272 PolarHBondContact O-N 2.89Å; N272-N274 PolarHBondContact O-N 3.17Å; N272-V328 HydrophobicContact CB-CG1 3.91Å; N272-V328 HydrophobicContact CB-CG2 4.08Å; N272-V328 WeakPolarHBondContact OD1-CG1 3.3Å
273	R	59.1	Low	53.7	Low	40 Å²	40	98 Å²	98	15%	0.151	51%	0.513	C	S	.	.			trans	-80.2	45	175	-71.4	165.2	84.7	-145	5.5	112.5	V179 L180 N181 C252 R269 S270 G275 V287 L326	V179-R273 PolarHBondContact O-NE 2.92Å; L180-R273 PolarHBondContact O-NH2 2.85Å; N181-R273 PolarHBondContact ND2-NH1 2.86Å; N181-R273 VanDerWaalsContact ND2-NH1 3.19Å; N181-R273 PolarHBondContact OD1-NH1 2.92Å; C252-R273 PolarHBondContact SG-NH2 3.05Å; R269-R273 WeakPolarHBondContact O-CG 3.46Å; S270-R273 PolarHBondContact O-N 2.81Å; R273-G275 PolarHBondContact O-N 2.9Å; R273-G275 VanDerWaalsContact O-N 3.11Å; R273-V287 HydrophobicContact CB-CG1 4.19Å; R273-V287 HydrophobicContact CG-CG1 4.31Å; R273-L326 HydrophobicContact CG-CD2 4.15Å
274	N	54.5	Low	54.7	Low	54 Å²	54	95.7 Å²	95.7	29%	0.289	50%	0.504	S	S	.	.			trans	-70.6	103.8	171.4	-68.1	-3.8	0	0	0	107.8	N272 C331	N272-N274 PolarHBondContact O-N 3.17Å; N274-C331 HydrophobicContact CB-CB 3.77Å
275	G	52.8	Low	56.2	Low	9 Å²	9	87.9 Å²	87.9	9%	0.093	48%	0.477	C	S	.	.			trans	-65.9	177.6	173	0	0	0	0	0	112	R273 G277 Y286	R273-G275 PolarHBondContact O-N 2.9Å; R273-G275 VanDerWaalsContact O-N 3.11Å; G275-G277 PolarHBondContact O-N 2.76Å; G275-Y286 WeakPolarHBondContact CA-O 3.48Å
276	L	53.8	Low	57.9	Low	127 Å²	127	86.4 Å²	86.4	67%	0.665	47%	0.466	S	S	*	.	S	Bend	trans	-79.2	71.8	-178.3	-69.2	164.9	0	0	0	111.5	R249 V288	R249-L276 VanDerWaalsContact CD-CD1 3.42Å; R249-L276 HydrophobicContact CG-CD1 3.73Å; L276-V288 HydrophobicContact CD1-CG2 4.08Å; L276-V288 HydrophobicContact CD2-CG2 4.34Å; L276-V288 HydrophobicContact CG-CG2 4.27Å
277	G	53.8	Low	59.5	Low	54 Å²	54	85.5 Å²	85.5	56%	0.557	46%	0.46	S	S	*	.	S	Bend	trans	119.4	177.2	-178.1	0	0	0	0	0	112.7	G275	G275-G277 PolarHBondContact O-N 2.76Å
278	T	54.1	Low	61.4	Low	115 Å²	115	80.9 Å²	80.9	71%	0.706	44%	0.442	S	S	*	.	S	Bend	trans	-66.1	136	174.8	45.2	0	0	0	0	110.6	K280	T278-K280 PolarHBondContact O-N 3.29Å
279	P	55.9	Low	63.4	Low	90 Å²	90	76 Å²	76	58%	0.584	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-65.8	120.7	178.9	26.8	-33.5	0	0	0	109.8
280	K	57.8	Low	65.1	Low	155 Å²	155	78 Å²	78	67%	0.674	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-85.4	132.5	171.7	-67.4	177.9	-176.9	173.5	0	108.9	T278 G282 E283	T278-K280 PolarHBondContact O-N 3.29Å; K280-G282 PolarHBondContact O-N 2.84Å; K280-E283 HydrophobicContact CB-CB 4.21Å; K280-E283 HydrophobicContact CB-CG 3.83Å; K280-E283 HydrophobicContact CD-CG 4.47Å; K280-E283 PolarHBondContact O-N 3.48Å; K280-E283 VanDerWaalsContact O-N 3.1Å
281	E	52.9	Low	67.1	Low	208 Å²	208	74.9 Å²	74.9	97%	0.972	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	119.9	179.8	-169.5	172.3	-171	0	0	110.7
282	G	63	Low	69.2	Low	82 Å²	82	67.9 Å²	67.9	85%	0.845	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	-15.6	-178	0	0	0	0	0	116.3	K280	K280-G282 PolarHBondContact O-N 2.84Å
283	E	71.7	Confident	71.2	Confident	136 Å²	136	65.4 Å²	65.4	64%	0.636	37%	0.371	S	S	*	.	S	Bend	trans	-81.2	144.2	178.1	-70.7	-67.8	156.8	0	0	112.1	K280 Q285	K280-E283 HydrophobicContact CB-CB 4.21Å; K280-E283 HydrophobicContact CB-CG 3.83Å; K280-E283 HydrophobicContact CD-CG 4.47Å; K280-E283 PolarHBondContact O-N 3.48Å; K280-E283 VanDerWaalsContact O-N 3.1Å; E283-Q285 PolarHBondContact O-N 3.12Å
284	P	74.1	Confident	72.6	Confident	53 Å²	53	67.3 Å²	67.3	34%	0.344	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-68.2	119.5	174.7	26.7	-31.7	0	0	0	111.2	Y286	P284-Y286 HydrophobicContact CB-CE2 4.17Å; P284-Y286 HydrophobicContact CG-CE2 3.91Å; P284-Y286 WeakPolarHBondContact O-CD2 3.18Å; P284-Y286 VanDerWaalsContact O-CE2 3.26Å; P284-Y286 WeakPolarHBondContact O-CE2 3.27Å
285	Q	80.3	Confident	74.2	Confident	63 Å²	63	65.8 Å²	65.8	29%	0.294	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-69.8	135.1	176.2	-178	70.5	-27.9	0	0	111	C252 E283	C252-Q285 HydrophobicContact CB-CB 4.24Å; C252-Q285 HydrophobicContact CB-CG 4.36Å; C252-Q285 PolarHBondContact N-O 2.92Å; E283-Q285 PolarHBondContact O-N 3.12Å
286	Y	84.6	Confident	75.7	Confident	44 Å²	44	70 Å²	70	17%	0.173	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.3	174.1	-64.6	-91.7	0	0	0	111.5	H197 R249 M250 R251 G275 P284	H197-Y286 HydrophobicContact CB-CD1 3.92Å; H197-Y286 HydrophobicContact CB-CE1 3.9Å; H197-Y286 HydrophobicContact CB-CG 4.38Å; H197-Y286 AromaticContact CD2-CD2 3.69Å; H197-Y286 AromaticContact CD2-CE2 3.71Å; R249-Y286 HydrophobicContact CB-CD1 4.43Å; M250-Y286 CarbonylContact O-C 3.6Å; M250-Y286 VanDerWaalsContact O-CA 3.31Å; M250-Y286 WeakPolarHBondContact O-CA 3.43Å; R251-Y286 HydrophobicContact CB-CD1 4.14Å; R251-Y286 HydrophobicContact CB-CE1 3.89Å; R251-Y286 HydrophobicContact CG-CE1 4.46Å; G275-Y286 WeakPolarHBondContact CA-O 3.48Å; P284-Y286 HydrophobicContact CB-CE2 4.17Å; P284-Y286 HydrophobicContact CG-CE2 3.91Å; P284-Y286 WeakPolarHBondContact O-CD2 3.18Å; P284-Y286 VanDerWaalsContact O-CE2 3.26Å; P284-Y286 WeakPolarHBondContact O-CE2 3.27Å
287	V	84.3	Confident	77	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.018	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151.1	173.7	-69.5	0	0	0	0	111.2	L180 R249 M250 C252 R273 V289 L326	L180-V287 HydrophobicContact CD2-CG2 3.6Å; R249-V287 CarbonylContact C-O 3.56Å; R249-V287 WeakPolarHBondContact CA-O 3.45Å; M250-V287 PolarHBondContact N-O 3.21Å; M250-V287 PolarHBondContact O-N 2.92Å; C252-V287 VanDerWaalsContact SG-CG1 3.58Å; R273-V287 HydrophobicContact CB-CG1 4.19Å; R273-V287 HydrophobicContact CG-CG1 4.31Å; V287-V289 HydrophobicContact CG2-CG2 4.22Å; V287-L326 HydrophobicContact CB-CD1 3.77Å; V287-L326 HydrophobicContact CG1-CD1 4.35Å; V287-L326 HydrophobicContact CG2-CD1 3.91Å
288	V	87.1	Confident	77.8	Confident	29 Å²	29	69.9 Å²	69.9	18%	0.176	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	120.7	179.9	-175.8	0	0	0	0	109.6	I247 L276 Q327	I247-V288 HydrophobicContact CG2-CG1 3.39Å; L276-V288 HydrophobicContact CD1-CG2 4.08Å; L276-V288 HydrophobicContact CD2-CG2 4.34Å; L276-V288 HydrophobicContact CG-CG2 4.27Å; V288-Q327 HydrophobicContact CB-CB 4.4Å; V288-Q327 HydrophobicContact CG1-CB 4.04Å; V288-Q327 PolarHBondContact O-N 2.92Å
289	V	89.4	Confident	78.1	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.3	180	-178.5	0	0	0	0	110	F158 L180 C248 M250 V287 R325	F158-V289 HydrophobicContact CE1-CG1 4.42Å; L180-V289 HydrophobicContact CD2-CG2 4.26Å; C248-V289 PolarHBondContact N-O 2.8Å; C248-V289 PolarHBondContact O-N 3.33Å; M250-V289 HydrophobicContact CB-CB 4.48Å; M250-V289 HydrophobicContact CB-CG2 3.85Å; M250-V289 HydrophobicContact CE-CG1 4.31Å; M250-V289 HydrophobicContact CG-CB 4.08Å; M250-V289 HydrophobicContact CG-CG2 3.97Å; M250-V289 HydrophobicContact SD-CB 3.74Å; M250-V289 HydrophobicContact SD-CG1 3.71Å; M250-V289 HydrophobicContact SD-CG2 3.75Å; V287-V289 HydrophobicContact CG2-CG2 4.22Å; V289-R325 CarbonylContact C-O 3.45Å; V289-R325 VanDerWaalsContact CA-O 3.31Å; V289-R325 WeakPolarHBondContact CA-O 3.42Å; V289-R325 WeakPolarHBondContact CG1-O 3.27Å
290	H	90.8	Very high	78.1	Confident	79 Å²	79	64.7 Å²	64.7	37%	0.366	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	113.2	170.8	-178.1	-140	0	0	0	109.2	S245 F246 I247 T292 R325	S245-H290 WeakPolarHBondContact CB-NE2 3.32Å; S245-H290 PolarHBondContact OG-NE2 3.32Å; F246-H290 PolarHBondContact O-CD2 3.41Å; I247-H290 HydrophobicContact CG1-CB 4.31Å; H290-T292 WeakPolarHBondContact CE1-CG2 3.5Å; H290-R325 PolarHBondContact N-O 3.5Å; H290-R325 PolarHBondContact O-N 2.7Å
291	C	92.8	Very high	77.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.9	179.8	-66.2	0	0	0	0	110.1	F160 S245 F246 M250 I323	F160-C291 HydrophobicContact CZ-CB 4.31Å; S245-C291 WeakPolarHBondContact CA-O 3.39Å; F246-C291 HydrophobicContact CD1-CB 4.37Å; F246-C291 HydrophobicContact CD2-CB 3.92Å; F246-C291 HydrophobicContact CE1-CB 4.01Å; F246-C291 HydrophobicContact CE2-CB 3.51Å; F246-C291 HydrophobicContact CG-CB 4.33Å; F246-C291 HydrophobicContact CZ-CB 3.56Å; F246-C291 PolarHBondContact N-O 3.17Å; F246-C291 PolarHBondContact O-N 3.35Å; M250-C291 VanDerWaalsContact CE-SG 3.54Å; C291-I323 WeakPolarHBondContact CA-O 3.18Å
292	T	91	Very high	77.6	Confident	22 Å²	22	56.8 Å²	56.8	14%	0.135	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.2	176.5	62.4	0	0	0	0	110.1	H290 A322 I323 R325	H290-T292 WeakPolarHBondContact CE1-CG2 3.5Å; T292-A322 WeakPolarHBondContact O-CA 3.34Å; T292-I323 PolarHBondContact N-O 3.01Å; T292-I323 PolarHBondContact O-N 3.33Å; T292-R325 PolarHBondContact OG1-NH1 2.91Å
293	G	90.9	Very high	76.9	Confident	11 Å²	11	56.7 Å²	56.7	11%	0.113	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	-167.2	-173.4	0	0	0	0	0	114.9	R243 R244 V321	R243-G293 WeakPolarHBondContact CG-O 3.42Å; R244-G293 PolarHBondContact N-O 3.02Å; R244-G293 PolarHBondContact O-N 3.28Å; R244-G293 VanDerWaalsContact O-O 3.1Å; G293-V321 CarbonylContact C-O 3.54Å; G293-V321 WeakPolarHBondContact CA-O 3.38Å
294	Y	88.7	Confident	75.6	Confident	80 Å²	80	55.6 Å²	55.6	31%	0.314	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	150.1	177.7	61.9	-84.6	0	0	0	111.8	M238 A242 K296 V321	M238-Y294 HydrophobicContact CE-CD1 3.47Å; M238-Y294 VanDerWaalsContact CE-CD1 3.47Å; M238-Y294 HydrophobicContact CE-CD2 3.53Å; M238-Y294 HydrophobicContact CE-CE1 3.7Å; M238-Y294 HydrophobicContact CE-CE2 3.75Å; M238-Y294 HydrophobicContact CE-CG 3.39Å; A242-Y294 CarbonylContact O-C 3.48Å; A242-Y294 VanDerWaalsContact O-CA 3.27Å; A242-Y294 WeakPolarHBondContact O-CA 3.41Å; Y294-K296 HydrophobicContact CD2-CB 4.3Å; Y294-K296 HydrophobicContact CE2-CB 4.06Å; Y294-K296 HydrophobicContact CE2-CD 4.27Å; Y294-K296 HydrophobicContact CE2-CG 4.47Å; Y294-V321 HydrophobicContact CE1-CB 4.06Å; Y294-V321 HydrophobicContact CE1-CG1 4.04Å; Y294-V321 HydrophobicContact CE2-CB 4.24Å; Y294-V321 HydrophobicContact CE2-CG2 4.4Å; Y294-V321 PolarHBondContact N-O 3.29Å; Y294-V321 PolarHBondContact O-N 2.89Å
295	I	88.8	Confident	74.5	Confident	21 Å²	21	58 Å²	58	11%	0.108	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	134	173.7	-51	-57.9	0	0	0	109.2	T210 A242 R244 Y318 C319 L320	T210-I295 HydrophobicContact CG2-CG2 4.49Å; A242-I295 PolarHBondContact O-N 3.45Å; R244-I295 HydrophobicContact CG-CD1 3.92Å; R244-I295 HydrophobicContact CG-CG1 4.12Å; I295-Y318 HydrophobicContact CG2-CD1 3.85Å; I295-Y318 HydrophobicContact CG2-CG 4.23Å; I295-C319 WeakPolarHBondContact CA-O 3.48Å; I295-L320 HydrophobicContact CD1-CB 3.97Å; I295-L320 HydrophobicContact CD1-CD1 4.03Å
296	K	84	Confident	73.2	Confident	99 Å²	99	60.5 Å²	60.5	43%	0.43	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.5	177.2	-168	-176.8	177.1	177.9	0	109.9	Y294 Y318 C319 V321	Y294-K296 HydrophobicContact CD2-CB 4.3Å; Y294-K296 HydrophobicContact CE2-CB 4.06Å; Y294-K296 HydrophobicContact CE2-CD 4.27Å; Y294-K296 HydrophobicContact CE2-CG 4.47Å; K296-Y318 WeakPolarHBondContact O-CA 3.4Å; K296-C319 PolarHBondContact N-O 3.17Å; K296-C319 PolarHBondContact O-N 2.68Å; K296-V321 HydrophobicContact CB-CG2 4.41Å
297	S	81.3	Confident	71.4	Confident	57 Å²	57	65.4 Å²	65.4	40%	0.399	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	148.8	170.4	47.5	0	0	0	0	112.4
298	W	69.1	Low	69.7	Low	121 Å²	121	72.6 Å²	72.6	46%	0.458	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	144.9	179	-171.2	-97.1	0	0	0	109.6	P300 R317	W298-P300 HydrophobicContact CE3-CG 4.03Å; W298-P300 HydrophobicContact CH2-CG 4.38Å; W298-P300 HydrophobicContact CZ3-CG 3.73Å; W298-R317 WeakPolarHBondContact CA-O 3.39Å; W298-R317 WeakPolarHBondContact CB-O 3.43Å; W298-R317 PolarHBondContact N-O 3.31Å; W298-R317 WeakPolarHBondContact O-CB 3.33Å; W298-R317 PolarHBondContact O-N 3Å
299	P	61	Low	68	Low	52 Å²	52	79.6 Å²	79.6	34%	0.338	46%	0.462	S	S	.	.	S	Bend	cis	-61.2	163.9	-12.7	29.4	-35.9	0	0	0	112	V303	P299-V303 HydrophobicContact CB-CB 4.48Å; P299-V303 WeakPolarHBondContact CB-O 3.31Å
300	P	57.3	Low	65.9	Low	43 Å²	43	82.7 Å²	82.7	28%	0.279	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-61.5	143.4	173	-18.3	32.7	0	0	0	110.3	W298 G302 V303	W298-P300 HydrophobicContact CE3-CG 4.03Å; W298-P300 HydrophobicContact CH2-CG 4.38Å; W298-P300 HydrophobicContact CZ3-CG 3.73Å; P300-G302 PolarHBondContact O-N 3.03Å; P300-V303 HydrophobicContact CB-CG2 4.26Å; P300-V303 HydrophobicContact CG-CG2 4.42Å; P300-V303 PolarHBondContact O-N 2.85Å
301	A	49.7	Very low	63.7	Low	112 Å²	112	85.6 Å²	85.6	93%	0.926	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	123.6	178.9	0	0	0	0	0	110.8
302	G	49.1	Very low	61.5	Low	85 Å²	85	92.7 Å²	92.7	88%	0.876	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.3	-6.4	-175.2	0	0	0	0	0	115.7	P300	P300-G302 PolarHBondContact O-N 3.03Å
303	V	48.9	Very low	59.4	Low	80 Å²	80	97.5 Å²	97.5	49%	0.485	57%	0.569	S	S	.	*			trans	-104.7	99	175.7	-171.9	0	0	0	0	110.5	P299 P300	P299-V303 HydrophobicContact CB-CB 4.48Å; P299-V303 WeakPolarHBondContact CB-O 3.31Å; P300-V303 HydrophobicContact CB-CG2 4.26Å; P300-V303 HydrophobicContact CG-CG2 4.42Å; P300-V303 PolarHBondContact O-N 2.85Å
304	S	45.2	Very low	57.3	Low	113 Å²	113	106.5 Å²	106.5	79%	0.79	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-76.3	125.6	167.5	52.5	0	0	0	0	110.3
305	L	51.1	Low	55.5	Low	104 Å²	104	104.7 Å²	104.7	55%	0.545	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-73.5	162.6	164.7	-63.3	172.1	0	0	0	109.7
306	T	51.6	Low	54	Low	116 Å²	116	107.3 Å²	107.3	71%	0.712	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-68.8	149.9	172.2	43.2	0	0	0	0	111.1	D308	T306-D308 PolarHBondContact O-N 3Å
307	D	47.5	Very low	53.5	Low	146 Å²	146	107.5 Å²	107.5	78%	0.781	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-61.9	-13.7	-166.5	-108.7	-14.8	0	0	0	115.6	E309 A310	D307-E309 VanDerWaalsContact C-N 3.3Å; D307-E309 PolarHBondContact O-N 2.82Å; D307-A310 WeakPolarHBondContact O-CB 3.03Å; D307-A310 PolarHBondContact O-N 3.35Å
308	D	49.2	Very low	53.8	Low	154 Å²	154	109.7 Å²	109.7	82%	0.824	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-71.5	-11.2	-171.4	-57.8	-74	0	0	0	115.7	T306	T306-D308 PolarHBondContact O-N 3Å
309	E	51	Low	54.8	Low	176 Å²	176	104.3 Å²	104.3	82%	0.822	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-110.7	22.5	170.8	-71.7	-158.7	138.3	0	0	113.1	D307 D311	D307-E309 VanDerWaalsContact C-N 3.3Å; D307-E309 PolarHBondContact O-N 2.82Å; E309-D311 VanDerWaalsContact C-N 3.27Å; E309-D311 PolarHBondContact O-N 3.3Å
310	A	45.7	Very low	56.2	Low	66 Å²	66	101.8 Å²	101.8	55%	0.545	60%	0.597	S	S	.	*			trans	-77.1	5.8	-174.3	0	0	0	0	0	116.3	D307 N312	D307-A310 WeakPolarHBondContact O-CB 3.03Å; D307-A310 PolarHBondContact O-N 3.35Å; A310-N312 PolarHBondContact O-N 2.87Å
311	D	43.9	Very low	57.9	Low	140 Å²	140	101 Å²	101	75%	0.749	59%	0.591	S	S	*	*	S	Bend	trans	-86.4	114.2	-169.7	-153.4	-7.8	0	0	0	114.3	E309 N313	E309-D311 VanDerWaalsContact C-N 3.27Å; E309-D311 PolarHBondContact O-N 3.3Å; D311-N313 PolarHBondContact O-N 2.95Å
312	N	46.4	Very low	59.9	Low	149 Å²	149	95.8 Å²	95.8	80%	0.797	55%	0.548	S	S	*	.	S	Bend	trans	69.1	22.1	150.9	-101	-52.7	0	0	0	123	A310	A310-N312 PolarHBondContact O-N 2.87Å
313	N	46.2	Very low	61.9	Low	123 Å²	123	93.1 Å²	93.1	66%	0.658	51%	0.513	S	S	*	.			trans	-154.7	93.1	149.7	-146.5	-6.8	0	0	0	114.7	D311 G315	D311-N313 PolarHBondContact O-N 2.95Å; N313-G315 PolarHBondContact O-N 2.99Å
314	Q	48.4	Very low	64	Low	199 Å²	199	89.3 Å²	89.3	93%	0.93	49%	0.49	S	S	*	.			trans	-78.9	46.6	177.2	-69.3	-171.9	-7.7	0	0	113.7
315	G	49.4	Very low	66	Low	42 Å²	42	87.9 Å²	87.9	43%	0.433	47%	0.467	S	S	.	.	S	Bend	trans	-83.9	142.4	163.4	0	0	0	0	0	110.7	N313 R317	N313-G315 PolarHBondContact O-N 2.99Å; G315-R317 PolarHBondContact O-N 3.45Å
316	S	57.6	Low	67.4	Low	77 Å²	77	84 Å²	84	54%	0.538	45%	0.447	S	S	.	.			trans	-53.3	111.3	168.3	-61.2	0	0	0	0	109.5	Y318	S316-Y318 WeakPolarHBondContact O-CD2 3.27Å; S316-Y318 VanDerWaalsContact O-CE2 3.22Å; S316-Y318 WeakPolarHBondContact O-CE2 3.46Å; S316-Y318 PolarHBondContact O-N 2.94Å; S316-Y318 VanDerWaalsContact O-N 3.15Å
317	R	74.6	Confident	68.5	Low	103 Å²	103	82 Å²	82	39%	0.389	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	112.5	-176.3	-60.8	-79.7	-95	175	-12.7	107.7	E165 W298 G315	E165-R317 IonicContact OE1-CZ 2.75Å; E165-R317 IonicContact OE1-NH1 2.72Å; E165-R317 PolarHBondContact OE1-NH1 3.22Å; E165-R317 IonicContact OE2-CZ 3.9Å; E165-R317 IonicContact OE2-NH1 3.64Å; E165-R317 PolarHBondContact OE2-NH1 3.4Å; W298-R317 WeakPolarHBondContact CA-O 3.39Å; W298-R317 WeakPolarHBondContact CB-O 3.43Å; W298-R317 PolarHBondContact N-O 3.31Å; W298-R317 WeakPolarHBondContact O-CB 3.33Å; W298-R317 PolarHBondContact O-N 3Å; G315-R317 PolarHBondContact O-N 3.45Å
318	Y	86.1	Confident	69.3	Low	102 Å²	102	78.6 Å²	78.6	40%	0.4	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	140.5	179.1	-67.2	-79.8	0	0	0	110.8	C164 T210 I295 K296 S316	C164-Y318 WeakPolarHBondContact CB-O 3.22Å; C164-Y318 PolarHBondContact N-O 3.45Å; C164-Y318 VanDerWaalsContact SG-C 3.6Å; C164-Y318 PolarHBondContact SG-O 3.33Å; T210-Y318 HydrophobicContact CG2-CD2 3.73Å; T210-Y318 HydrophobicContact CG2-CG 3.71Å; I295-Y318 HydrophobicContact CG2-CD1 3.85Å; I295-Y318 HydrophobicContact CG2-CG 4.23Å; K296-Y318 WeakPolarHBondContact O-CA 3.4Å; S316-Y318 WeakPolarHBondContact O-CD2 3.27Å; S316-Y318 VanDerWaalsContact O-CE2 3.22Å; S316-Y318 WeakPolarHBondContact O-CE2 3.46Å; S316-Y318 PolarHBondContact O-N 2.94Å; S316-Y318 VanDerWaalsContact O-N 3.15Å
319	C	90.5	Very high	69.5	Low	8 Å²	8	74.7 Å²	74.7	5%	0.054	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.8	174.3	-65	0	0	0	0	110.3	V161 V162 I295 K296	V161-C319 HydrophobicContact CG1-CB 3.81Å; V162-C319 CarbonylContact O-C 3.58Å; V162-C319 WeakPolarHBondContact O-CA 3.24Å; V162-C319 WeakPolarHBondContact O-CB 3.17Å; I295-C319 WeakPolarHBondContact CA-O 3.48Å; K296-C319 PolarHBondContact N-O 3.17Å; K296-C319 PolarHBondContact O-N 2.68Å
320	L	91.8	Very high	69	Low	0 Å²	0	72.3 Å²	72.3	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122.1	165.8	170.4	65.6	0	0	0	108.4	V161 V162 L208 R244 F246 I295 A322	V161-L320 VanDerWaalsContact CA-O 3.27Å; V161-L320 WeakPolarHBondContact CA-O 3.39Å; V162-L320 HydrophobicContact CG2-CB 3.89Å; V162-L320 HydrophobicContact CG2-CD2 4.22Å; V162-L320 HydrophobicContact CG2-CG 4.41Å; V162-L320 PolarHBondContact N-O 3.29Å; V162-L320 PolarHBondContact O-N 2.84Å; L208-L320 HydrophobicContact CD2-CB 3.76Å; L208-L320 HydrophobicContact CD2-CD2 3.71Å; L208-L320 HydrophobicContact CD2-CG 4.38Å; R244-L320 HydrophobicContact CB-CD1 3.98Å; R244-L320 HydrophobicContact CG-CD1 4.19Å; F246-L320 HydrophobicContact CE1-CD2 3.89Å; F246-L320 HydrophobicContact CZ-CD2 4.11Å; I295-L320 HydrophobicContact CD1-CB 3.97Å; I295-L320 HydrophobicContact CD1-CD1 4.03Å; L320-A322 HydrophobicContact CD1-CB 4.16Å; L320-A322 HydrophobicContact CD2-CB 4.19Å; L320-A322 HydrophobicContact CG-CB 3.95Å
321	V	91.5	Very high	68.8	Low	26 Å²	26	71.2 Å²	71.2	16%	0.158	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.9	167.7	-179.2	0	0	0	0	107.5	L159 V161 G293 Y294 K296	L159-V321 HydrophobicContact CD1-CG1 4.32Å; V161-V321 HydrophobicContact CG1-CG2 4.13Å; V161-V321 HydrophobicContact CG2-CB 4.48Å; V161-V321 HydrophobicContact CG2-CG1 4.27Å; V161-V321 HydrophobicContact CG2-CG2 4.11Å; G293-V321 CarbonylContact C-O 3.54Å; G293-V321 WeakPolarHBondContact CA-O 3.38Å; Y294-V321 HydrophobicContact CE1-CB 4.06Å; Y294-V321 HydrophobicContact CE1-CG1 4.04Å; Y294-V321 HydrophobicContact CE2-CB 4.24Å; Y294-V321 HydrophobicContact CE2-CG2 4.4Å; Y294-V321 PolarHBondContact N-O 3.29Å; Y294-V321 PolarHBondContact O-N 2.89Å; K296-V321 HydrophobicContact CB-CG2 4.41Å
322	A	92.4	Very high	68.8	Low	2 Å²	2	70.7 Å²	70.7	2%	0.017	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.6	-172.2	0	0	0	0	0	113.7	F160 T292 L320	F160-A322 HydrophobicContact CE1-CB 4.06Å; F160-A322 HydrophobicContact CE2-CB 3.95Å; F160-A322 HydrophobicContact CZ-CB 3.71Å; F160-A322 PolarHBondContact N-O 3.06Å; F160-A322 PolarHBondContact O-N 2.8Å; F160-A322 VanDerWaalsContact O-O 3.12Å; T292-A322 WeakPolarHBondContact O-CA 3.34Å; L320-A322 HydrophobicContact CD1-CB 4.16Å; L320-A322 HydrophobicContact CD2-CB 4.19Å; L320-A322 HydrophobicContact CG-CB 3.95Å
323	I	91.7	Very high	68.6	Low	30 Å²	30	66 Å²	66	15%	0.154	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.4	167.4	-60.5	173.7	0	0	0	107.6	I151 A155 F158 L159 C291 T292 R325	I151-I323 HydrophobicContact CG2-CD1 3.98Å; A155-I323 HydrophobicContact CB-CG2 4.24Å; F158-I323 CarbonylContact O-C 3.52Å; F158-I323 WeakPolarHBondContact O-CA 3.44Å; L159-I323 HydrophobicContact CD1-CG1 3.8Å; C291-I323 WeakPolarHBondContact CA-O 3.18Å; T292-I323 PolarHBondContact N-O 3.01Å; T292-I323 PolarHBondContact O-N 3.33Å; I323-R325 HydrophobicContact CG2-CG 4.12Å
324	G	91.1	Very high	68.2	Low	0 Å²	0	65.9 Å²	65.9	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.1	169.1	0	0	0	0	0	110.2	G157 F158	G157-G324 CarbonylContact C-O 3.59Å; G157-G324 WeakPolarHBondContact CA-O 3.37Å; F158-G324 WeakPolarHBondContact CD1-O 3.2Å; F158-G324 PolarHBondContact N-O 3.5Å; F158-G324 PolarHBondContact O-N 2.87Å
325	R	87.7	Confident	67.8	Low	82 Å²	82	61.6 Å²	61.6	31%	0.309	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	137	176.8	-60.1	-172	162.9	82.7	0.3	110.6	A155 V289 H290 T292 I323 Q327	A155-R325 WeakPolarHBondContact O-CD 3.45Å; A155-R325 WeakPolarHBondContact O-CG 3.47Å; A155-R325 PolarHBondContact O-NE 3Å; V289-R325 CarbonylContact C-O 3.45Å; V289-R325 VanDerWaalsContact CA-O 3.31Å; V289-R325 WeakPolarHBondContact CA-O 3.42Å; V289-R325 WeakPolarHBondContact CG1-O 3.27Å; H290-R325 PolarHBondContact N-O 3.5Å; H290-R325 PolarHBondContact O-N 2.7Å; T292-R325 PolarHBondContact OG1-NH1 2.91Å; I323-R325 HydrophobicContact CG2-CG 4.12Å; R325-Q327 PolarHBondContact O-N 2.66Å
326	L	81.7	Confident	67.3	Low	22 Å²	22	64.2 Å²	64.2	12%	0.115	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	118.5	173.6	-179.1	65.8	0	0	0	109	D156 V179 R273 V287 V328	D156-L326 PolarHBondContact O-N 2.76Å; V179-L326 HydrophobicContact CG1-CB 4.35Å; R273-L326 HydrophobicContact CG-CD2 4.15Å; V287-L326 HydrophobicContact CB-CD1 3.77Å; V287-L326 HydrophobicContact CG1-CD1 4.35Å; V287-L326 HydrophobicContact CG2-CD1 3.91Å; L326-V328 HydrophobicContact CD2-CG2 4.35Å; L326-V328 HydrophobicContact CG-CG2 4.37Å; L326-V328 PolarHBondContact O-N 3.46Å
327	Q	74.3	Confident	66.7	Low	75 Å²	75	69.5 Å²	69.5	35%	0.35	39%	0.388	S	S	.	.			trans	-83.4	96.1	177.2	-173.6	175	-13.1	0	0	109.3	V288 R325 T329	V288-Q327 HydrophobicContact CB-CB 4.4Å; V288-Q327 HydrophobicContact CG1-CB 4.04Å; V288-Q327 PolarHBondContact O-N 2.92Å; R325-Q327 PolarHBondContact O-N 2.66Å; Q327-T329 HydrophobicContact CG-CG2 4.36Å; Q327-T329 PolarHBondContact O-N 2.84Å
328	V	63.7	Low	64.9	Low	74 Å²	74	71.2 Å²	71.2	45%	0.448	41%	0.405	S	S	.	.			trans	-73.5	81	172	-176.3	0	0	0	0	109.3	N272 L326	N272-V328 HydrophobicContact CB-CG1 3.91Å; N272-V328 HydrophobicContact CB-CG2 4.08Å; N272-V328 WeakPolarHBondContact OD1-CG1 3.3Å; L326-V328 HydrophobicContact CD2-CG2 4.35Å; L326-V328 HydrophobicContact CG-CG2 4.37Å; L326-V328 PolarHBondContact O-N 3.46Å
329	T	54.7	Low	62.5	Low	72 Å²	72	71.1 Å²	71.1	44%	0.442	42%	0.42	S	S	.	.			trans	-68.9	134.1	155.3	44.5	0	0	0	0	108.6	Q327 C331	Q327-T329 HydrophobicContact CG-CG2 4.36Å; Q327-T329 PolarHBondContact O-N 2.84Å; T329-C331 PolarHBondContact O-N 3.29Å
330	C	40	Very low	60	Low	126 Å²	126	78.5 Å²	78.5	85%	0.851	46%	0.457	S	S	*	.			trans	-69.9	73	175.3	-61.9	0	0	0	0	111.5
331	C	41.9	Very low	57.6	Low	44 Å²	44	82.3 Å²	82.3	30%	0.297	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-57.3	135.7	163	-60.3	0	0	0	0	108	N274 T329 G333	N274-C331 HydrophobicContact CB-CB 3.77Å; T329-C331 PolarHBondContact O-N 3.29Å; C331-G333 PolarHBondContact O-N 3.41Å; C331-G333 VanDerWaalsContact O-N 3.14Å
332	P	44	Very low	55.6	Low	128 Å²	128	86 Å²	86	83%	0.831	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-54.6	124.6	178.2	23.5	-33.2	0	0	0	108.9	D334	P332-D334 PolarHBondContact O-N 3.14Å
333	G	41.7	Very low	53.8	Low	51 Å²	51	89.4 Å²	89.4	53%	0.526	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-68.5	123.7	-162.9	0	0	0	0	0	112.7	C331 T335	C331-G333 PolarHBondContact O-N 3.41Å; C331-G333 VanDerWaalsContact O-N 3.14Å; G333-T335 VanDerWaalsContact C-N 3.32Å; G333-T335 PolarHBondContact O-N 3.43Å; G333-T335 PolarHBondContact O-OG1 3.48Å
334	D	37.2	Very low	52.9	Low	121 Å²	121	90.5 Å²	90.5	65%	0.647	54%	0.536	S	S	*	.			trans	-58.9	99.3	162.3	-105.7	-32.9	0	0	0	108.1	P332 D336	P332-D334 PolarHBondContact O-N 3.14Å; D334-D336 PolarHBondContact O-N 3.17Å
335	T	39.9	Very low	52.8	Low	108 Å²	108	93 Å²	93	66%	0.663	55%	0.548	S	S	*	.			trans	-88.6	101.1	-170.8	-58.5	0	0	0	0	108.4	G333	G333-T335 VanDerWaalsContact C-N 3.32Å; G333-T335 PolarHBondContact O-N 3.43Å; G333-T335 PolarHBondContact O-OG1 3.48Å
336	D	38.5	Very low	53	Low	97 Å²	97	89.2 Å²	89.2	52%	0.519	53%	0.533	S	S	.	.			trans	72.8	96.2	166.1	-57.6	-31.2	0	0	0	117.2	R271 D334 N338	R271-D336 IonicContact CZ-OD1 2.92Å; R271-D336 IonicContact NH2-OD1 2.64Å; R271-D336 PolarHBondContact NH2-OD1 3.46Å; D334-D336 PolarHBondContact O-N 3.17Å; D336-N338 PolarHBondContact O-N 2.96Å
337	L	46	Very low	53.6	Low	188 Å²	188	90.9 Å²	90.9	98%	0.984	54%	0.542	S	S	*	.	S	Bend	trans	-66.6	30.2	166.5	-163.4	70.2	0	0	0	113
338	N	36.2	Very low	54.7	Low	140 Å²	140	87.3 Å²	87.3	75%	0.749	53%	0.525	S	S	*	.	S	Bend	trans	-148.8	82.3	-175.8	-153	10.9	0	0	0	114.7	D336	D336-N338 PolarHBondContact O-N 2.96Å
339	S	36.1	Very low	56.3	Low	100 Å²	100	87.5 Å²	87.5	70%	0.699	52%	0.518	S	S	*	.	S	Bend	trans	77.4	150.2	165.9	82.6	0	0	0	0	118.6
340	I	38.5	Very low	58.4	Low	163 Å²	163	84.1 Å²	84.1	84%	0.836	50%	0.497	S	S	*	.	S	Bend	trans	69.8	129.1	-175.4	-50.1	178.1	0	0	0	112.9	V342	I340-V342 PolarHBondContact O-N 3.24Å
341	S	40.1	Very low	61	Low	80 Å²	80	80.1 Å²	80.1	56%	0.559	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-64.7	127.8	-167.6	66.5	0	0	0	0	112.9	K448	S341-K448 PolarHBondContact OG-NZ 2.67Å
342	V	50.2	Low	63.3	Low	103 Å²	103	80.3 Å²	80.3	62%	0.624	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-46.1	129.7	164	-175.3	0	0	0	0	109.1	I340 V344	I340-V342 PolarHBondContact O-N 3.24Å; V342-V344 PolarHBondContact O-N 2.75Å
343	P	54.4	Low	65.6	Low	74 Å²	74	80.8 Å²	80.8	48%	0.481	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-56.5	137.8	175.2	-24.1	34.1	0	0	0	110.4	E345 V445	P343-E345 PolarHBondContact O-N 3.2Å; P343-V445 HydrophobicContact CB-CG1 3.67Å
344	V	74	Confident	68.1	Low	53 Å²	53	78.5 Å²	78.5	32%	0.321	44%	0.435	S	S	.	.			trans	-80.5	73.2	-177.6	-165.5	0	0	0	0	109.3	V342 S366	V342-V344 PolarHBondContact O-N 2.75Å; V344-S366 WeakPolarHBondContact O-CB 3.5Å; V344-S366 PolarHBondContact O-OG 2.78Å
345	E	87.6	Confident	71	Confident	53 Å²	53	76.5 Å²	76.5	25%	0.248	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	158.1	-175.4	61.2	141.5	-118.9	0	0	113.8	P343 R362 T443 N444 V445	P343-E345 PolarHBondContact O-N 3.2Å; E345-R362 WeakPolarHBondContact O-CB 3.49Å; E345-R362 IonicContact OE1-CZ 2.89Å; E345-R362 IonicContact OE1-NH1 3.62Å; E345-R362 PolarHBondContact OE1-NH1 3.33Å; E345-R362 IonicContact OE1-NH2 2.76Å; E345-R362 PolarHBondContact OE1-NH2 2.8Å; E345-R362 VanDerWaalsContact OE1-NH2 3.09Å; E345-T443 WeakPolarHBondContact OE2-CG2 3.33Å; E345-N444 CarbonylContact C-O 3.58Å; E345-N444 WeakPolarHBondContact CA-O 3.49Å; E345-N444 WeakPolarHBondContact CB-O 3.39Å; E345-V445 HydrophobicContact CB-CG2 4.04Å
346	F	91.7	Very high	73.7	Confident	1 Å²	1	71.6 Å²	71.6	0%	0.004	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	147.9	170.5	70	-81.3	0	0	0	111.1	V359 D360 R362 C363 S366 I367 M422 N444	F346-V359 HydrophobicContact CD2-CG1 3.84Å; F346-V359 HydrophobicContact CE2-CG1 4.01Å; F346-D360 HydrophobicContact CB-CB 4.36Å; F346-R362 HydrophobicContact CB-CB 3.88Å; F346-C363 HydrophobicContact CB-CB 4.22Å; F346-C363 HydrophobicContact CD1-CB 4.35Å; F346-C363 HydrophobicContact CD2-CB 3.66Å; F346-C363 HydrophobicContact CE2-CB 4.08Å; F346-C363 HydrophobicContact CG-CB 3.81Å; F346-S366 WeakPolarHBondContact CD1-OG 3.3Å; F346-I367 HydrophobicContact CE1-CD1 3.96Å; F346-I367 HydrophobicContact CE1-CG1 4.21Å; F346-I367 HydrophobicContact CE1-CG2 4.05Å; F346-I367 HydrophobicContact CE2-CD1 4.21Å; F346-I367 HydrophobicContact CZ-CD1 3.59Å; F346-I367 HydrophobicContact CZ-CG1 4.32Å; F346-M422 HydrophobicContact CE1-CE 3.73Å; F346-M422 HydrophobicContact CE1-SD 4.47Å; F346-M422 HydrophobicContact CZ-CE 4.14Å; F346-M422 HydrophobicContact CZ-SD 4.48Å; F346-N444 HydrophobicContact CD1-CB 4Å; F346-N444 HydrophobicContact CD2-CB 4.48Å; F346-N444 HydrophobicContact CE1-CB 3.6Å; F346-N444 HydrophobicContact CE2-CB 4.11Å; F346-N444 HydrophobicContact CG-CB 4.43Å; F346-N444 HydrophobicContact CZ-CB 3.65Å; F346-N444 PolarHBondContact N-O 2.72Å; F346-N444 WeakPolarHBondContact O-CB 3.21Å; F346-N444 PolarHBondContact O-N 2.78Å; F346-N444 PolarHBondContact O-ND2 3.13Å
347	I	94.5	Very high	76.5	Confident	57 Å²	57	70.5 Å²	70.5	29%	0.292	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	139.7	175.5	-63.8	166.4	0	0	0	109.6	D360 I441 C442	I347-D360 HydrophobicContact CB-CB 4.15Å; I347-D360 PolarHBondContact N-OD2 3.41Å; I347-D360 WeakPolarHBondContact O-CB 3.18Å; I347-D360 PolarHBondContact O-N 2.79Å; I347-I441 HydrophobicContact CG2-CG2 4.35Å; I347-C442 WeakPolarHBondContact CA-O 3.07Å
348	S	97.1	Very high	79	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153	163.8	51	0	0	0	0	110.4	H350 F358 C442 N444	S348-H350 PolarHBondContact OG-NE2 3.24Å; S348-F358 CarbonylContact C-O 3.58Å; S348-F358 VanDerWaalsContact CA-O 3.25Å; S348-F358 WeakPolarHBondContact CA-O 3.44Å; S348-F358 WeakPolarHBondContact CB-O 3.42Å; S348-C442 PolarHBondContact N-O 2.93Å; S348-C442 PolarHBondContact O-N 3.49Å; S348-N444 PolarHBondContact OG-ND2 2.67Å
349	R	97.9	Very high	81.7	Confident	79 Å²	79	59 Å²	59	30%	0.298	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	145.9	165.1	-55.8	-177.4	-80.5	166	-3.5	109.1	T357 F358 Y439 I440 I441	R349-T357 VanDerWaalsContact C-OG1 3.31Å; R349-T357 PolarHBondContact O-N 3.45Å; R349-T357 PolarHBondContact O-OG1 3.03Å; R349-F358 HydrophobicContact CB-CB 3.91Å; R349-F358 HydrophobicContact CG-CB 4.12Å; R349-F358 HydrophobicContact CG-CD1 4.18Å; R349-F358 PolarHBondContact N-O 3.42Å; R349-F358 PolarHBondContact O-N 2.81Å; R349-Y439 HydrophobicContact CB-CD2 4.3Å; R349-Y439 HydrophobicContact CB-CG 4.29Å; R349-Y439 HydrophobicContact CG-CD2 4.11Å; R349-Y439 HydrophobicContact CG-CE2 4.49Å; R349-Y439 VanDerWaalsContact NH1-CZ 3.27Å; R349-Y439 PolarHBondContact NH1-OH 2.93Å; R349-I440 CarbonylContact C-O 3.45Å; R349-I440 VanDerWaalsContact CA-O 3.3Å; R349-I440 WeakPolarHBondContact CA-O 3.44Å; R349-I441 HydrophobicContact CG-CG1 4.35Å
350	H	97.9	Very high	84.1	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.7	-177.8	-59	-98.6	0	0	0	110.2	S348 M355 F356 F395 Y439 I440 C442	S348-H350 PolarHBondContact OG-NE2 3.24Å; H350-M355 WeakPolarHBondContact CA-O 3.16Å; H350-F356 AromaticContact CE1-CD1 3.25Å; H350-F356 WeakPolarHBondContact CE1-CD1 3.5Å; H350-F356 AromaticContact CE1-CE1 3.27Å; H350-F356 WeakPolarHBondContact CE1-CE1 3.39Å; H350-F356 AromaticContact CE1-CG 3.83Å; H350-F356 AromaticContact CE1-CZ 3.83Å; H350-F356 AromaticContact ND1-CD1 3.91Å; H350-F356 AromaticContact NE2-CD1 3.83Å; H350-F356 AromaticContact NE2-CE1 3.76Å; H350-F395 HydrophobicContact CB-CE1 3.86Å; H350-F395 HydrophobicContact CB-CZ 4.48Å; H350-F395 AromaticContact CG-CE1 3.93Å; H350-Y439 CarbonylContact O-C 3.57Å; H350-Y439 VanDerWaalsContact O-CA 3.23Å; H350-Y439 WeakPolarHBondContact O-CA 3.09Å; H350-Y439 WeakPolarHBondContact O-CB 3.4Å; H350-I440 HydrophobicContact CB-CB 4.45Å; H350-I440 PolarHBondContact N-O 2.85Å; H350-I440 PolarHBondContact O-N 2.68Å; H350-C442 PolarHBondContact CD2-SG 3Å
351	N	95.3	Very high	86.3	Confident	43 Å²	43	53.6 Å²	53.6	23%	0.23	29%	0.287	C	S	.	.			trans	-75.3	173.5	161.8	71.9	0.8	0	0	0	110.8	Q353 G354 M355 T357	N351-Q353 PolarHBondContact O-N 3.19Å; N351-Q353 WeakPolarHBondContact OD1-CA 3.18Å; N351-Q353 WeakPolarHBondContact OD1-CB 3.45Å; N351-Q353 PolarHBondContact OD1-N 3.16Å; N351-G354 PolarHBondContact O-N 3.34Å; N351-G354 PolarHBondContact OD1-N 3.05Å; N351-M355 PolarHBondContact N-O 2.9Å; N351-M355 VanDerWaalsContact N-O 3.08Å; N351-M355 WeakPolarHBondContact ND2-CE 3.37Å; N351-M355 WeakPolarHBondContact OD1-CB 3.36Å; N351-M355 PolarHBondContact OD1-N 2.99Å; N351-T357 HydrophobicContact CB-CG2 4.17Å
352	C	91.6	Very high	88.5	Confident	48 Å²	48	54.5 Å²	54.5	32%	0.324	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	7.2	177.4	-53.6	0	0	0	0	114.9	V399	C352-V399 HydrophobicContact CB-CG2 4.36Å
353	Q	91.6	Very high	90.3	Very high	138 Å²	138	49.6 Å²	49.6	65%	0.645	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.2	3.6	173.2	-62.1	-65.7	-77.7	0	0	112.2	N351 N378	N351-Q353 PolarHBondContact O-N 3.19Å; N351-Q353 WeakPolarHBondContact OD1-CA 3.18Å; N351-Q353 WeakPolarHBondContact OD1-CB 3.45Å; N351-Q353 PolarHBondContact OD1-N 3.16Å; Q353-N378 PolarHBondContact O-ND2 3.45Å
354	G	94.1	Very high	91.9	Very high	2 Å²	2	49 Å²	49	2%	0.021	24%	0.241	C	C	.	.	S	Bend	trans	76.9	19.8	-178	0	0	0	0	0	114.4	N351 N378 I379	N351-G354 PolarHBondContact O-N 3.34Å; N351-G354 PolarHBondContact OD1-N 3.05Å; G354-N378 CarbonylContact O-C 3.58Å; G354-N378 WeakPolarHBondContact O-CA 3.41Å; G354-N378 PolarHBondContact O-OD1 3.21Å; G354-I379 PolarHBondContact O-N 2.85Å
355	M	97.4	Very high	92.3	Very high	79 Å²	79	50.6 Å²	50.6	39%	0.389	26%	0.259	S	S	.	.	B	Isolated β-bridge	trans	-87.1	130.4	172.5	-58.3	-159.2	-60.6	0	0	111.3	H350 N351 T357 K377	H350-M355 WeakPolarHBondContact CA-O 3.16Å; N351-M355 PolarHBondContact N-O 2.9Å; N351-M355 VanDerWaalsContact N-O 3.08Å; N351-M355 WeakPolarHBondContact ND2-CE 3.37Å; N351-M355 WeakPolarHBondContact OD1-CB 3.36Å; N351-M355 PolarHBondContact OD1-N 2.99Å; M355-T357 PolarHBondContact O-N 2.95Å; M355-T357 VanDerWaalsContact O-N 3.15Å; M355-K377 VanDerWaalsContact CA-O 3.28Å; M355-K377 WeakPolarHBondContact CA-O 3.39Å
356	F	97.8	Very high	92.2	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.022	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	112.4	178.1	-71.7	-79.3	0	0	0	111.7	H350 V359 L374 G376 K377 I379 F382 F412	H350-F356 AromaticContact CE1-CD1 3.25Å; H350-F356 WeakPolarHBondContact CE1-CD1 3.5Å; H350-F356 AromaticContact CE1-CE1 3.27Å; H350-F356 WeakPolarHBondContact CE1-CE1 3.39Å; H350-F356 AromaticContact CE1-CG 3.83Å; H350-F356 AromaticContact CE1-CZ 3.83Å; H350-F356 AromaticContact ND1-CD1 3.91Å; H350-F356 AromaticContact NE2-CD1 3.83Å; H350-F356 AromaticContact NE2-CE1 3.76Å; F356-V359 HydrophobicContact CB-CG2 4.17Å; F356-V359 HydrophobicContact CD1-CG2 3.54Å; F356-V359 HydrophobicContact CE1-CG2 4.16Å; F356-V359 HydrophobicContact CG-CG2 4.09Å; F356-L374 WeakPolarHBondContact CB-O 3.33Å; F356-L374 HydrophobicContact CD2-CB 4.18Å; F356-L374 WeakPolarHBondContact CD2-O 3.23Å; F356-L374 HydrophobicContact CE2-CB 4.37Å; F356-L374 HydrophobicContact CE2-CD2 4.44Å; F356-L374 HydrophobicContact CG-CB 4.34Å; F356-G376 PolarHBondContact O-N 3.49Å; F356-K377 WeakPolarHBondContact CD2-O 3.47Å; F356-K377 PolarHBondContact N-O 3.5Å; F356-I379 HydrophobicContact CE2-CB 4.27Å; F356-I379 HydrophobicContact CE2-CG1 4.48Å; F356-I379 HydrophobicContact CZ-CB 4.34Å; F356-I379 HydrophobicContact CZ-CG1 4.13Å; F356-F382 HydrophobicContact CE2-CD2 4.02Å; F356-F382 HydrophobicContact CE2-CE2 4.1Å; F356-F412 HydrophobicContact CZ-CE2 4.44Å
357	T	97	Very high	92.2	Very high	74 Å²	74	48.5 Å²	48.5	45%	0.454	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-22.4	173	56.9	0	0	0	0	112.6	R349 N351 M355 L375	R349-T357 VanDerWaalsContact C-OG1 3.31Å; R349-T357 PolarHBondContact O-N 3.45Å; R349-T357 PolarHBondContact O-OG1 3.03Å; N351-T357 HydrophobicContact CB-CG2 4.17Å; M355-T357 PolarHBondContact O-N 2.95Å; M355-T357 VanDerWaalsContact O-N 3.15Å; T357-L375 VanDerWaalsContact C-CD2 3.49Å; T357-L375 WeakPolarHBondContact O-CD2 3.3Å
358	F	97.4	Very high	92	Very high	80 Å²	80	47.2 Å²	47.2	35%	0.351	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	143.6	173	172	-93.7	0	0	0	110.2	S348 R349 D360	S348-F358 CarbonylContact C-O 3.58Å; S348-F358 VanDerWaalsContact CA-O 3.25Å; S348-F358 WeakPolarHBondContact CA-O 3.44Å; S348-F358 WeakPolarHBondContact CB-O 3.42Å; R349-F358 HydrophobicContact CB-CB 3.91Å; R349-F358 HydrophobicContact CG-CB 4.12Å; R349-F358 HydrophobicContact CG-CD1 4.18Å; R349-F358 PolarHBondContact N-O 3.42Å; R349-F358 PolarHBondContact O-N 2.81Å; F358-D360 HydrophobicContact CE1-CB 4.3Å
359	V	94	Very high	91.9	Very high	8 Å²	8	48.6 Å²	48.6	5%	0.048	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	129.6	168.1	-166.4	0	0	0	0	110.1	F346 F356 C363 P371 L374 L375	F346-V359 HydrophobicContact CD2-CG1 3.84Å; F346-V359 HydrophobicContact CE2-CG1 4.01Å; F356-V359 HydrophobicContact CB-CG2 4.17Å; F356-V359 HydrophobicContact CD1-CG2 3.54Å; F356-V359 HydrophobicContact CE1-CG2 4.16Å; F356-V359 HydrophobicContact CG-CG2 4.09Å; V359-C363 HydrophobicContact CG1-CB 3.65Å; V359-P371 HydrophobicContact CB-CB 4.23Å; V359-L374 HydrophobicContact CG1-CD1 3.96Å; V359-L374 HydrophobicContact CG2-CB 3.98Å; V359-L374 HydrophobicContact CG2-CD1 4.26Å; V359-L375 HydrophobicContact CG2-CD2 4.45Å
360	D	86.9	Confident	91.6	Very high	31 Å²	31	48.1 Å²	48.1	17%	0.166	26%	0.258	C	S	.	.			trans	-63.3	136.7	171.8	178.7	-14.4	0	0	0	111.2	F346 I347 F358 R362 C363	F346-D360 HydrophobicContact CB-CB 4.36Å; I347-D360 HydrophobicContact CB-CB 4.15Å; I347-D360 PolarHBondContact N-OD2 3.41Å; I347-D360 WeakPolarHBondContact O-CB 3.18Å; I347-D360 PolarHBondContact O-N 2.79Å; F358-D360 HydrophobicContact CE1-CB 4.3Å; D360-R362 PolarHBondContact O-N 2.92Å; D360-R362 VanDerWaalsContact O-N 3.08Å; D360-R362 WeakPolarHBondContact OD1-CB 3.39Å; D360-R362 WeakPolarHBondContact OD1-CG 3.34Å; D360-R362 PolarHBondContact OD1-N 3.22Å; D360-R362 IonicContact OD1-NE 3.1Å; D360-R362 IonicContact OD2-CZ 3.62Å; D360-R362 IonicContact OD2-NE 3.55Å; D360-R362 PolarHBondContact OD2-NE 2.82Å; D360-R362 IonicContact OD2-NH2 3.53Å; D360-R362 PolarHBondContact OD2-NH2 2.9Å; D360-C363 VanDerWaalsContact O-CB 3.31Å; D360-C363 WeakPolarHBondContact O-CB 3.16Å; D360-C363 PolarHBondContact O-N 3.31Å; D360-C363 PolarHBondContact O-SG 2.81Å
361	H	83.4	Confident	91.4	Very high	117 Å²	117	48.8 Å²	48.8	54%	0.542	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-19	-179.2	-168.7	59.7	0	0	0	113.7	C363 L364 Q370	H361-C363 PolarHBondContact O-N 2.64Å; H361-L364 WeakPolarHBondContact O-CB 3.06Å; H361-L364 PolarHBondContact O-N 2.91Å; H361-Q370 PolarHBondContact CE1-OE1 2.94Å
362	R	85.9	Confident	91.4	Very high	99 Å²	99	53.5 Å²	53.5	37%	0.374	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-19.3	169	-68.6	-173.9	-68.4	157.2	7.3	113.4	E345 F346 D360 L364 A365 S366	E345-R362 WeakPolarHBondContact O-CB 3.49Å; E345-R362 IonicContact OE1-CZ 2.89Å; E345-R362 IonicContact OE1-NH1 3.62Å; E345-R362 PolarHBondContact OE1-NH1 3.33Å; E345-R362 IonicContact OE1-NH2 2.76Å; E345-R362 PolarHBondContact OE1-NH2 2.8Å; E345-R362 VanDerWaalsContact OE1-NH2 3.09Å; F346-R362 HydrophobicContact CB-CB 3.88Å; D360-R362 PolarHBondContact O-N 2.92Å; D360-R362 VanDerWaalsContact O-N 3.08Å; D360-R362 WeakPolarHBondContact OD1-CB 3.39Å; D360-R362 WeakPolarHBondContact OD1-CG 3.34Å; D360-R362 PolarHBondContact OD1-N 3.22Å; D360-R362 IonicContact OD1-NE 3.1Å; D360-R362 IonicContact OD2-CZ 3.62Å; D360-R362 IonicContact OD2-NE 3.55Å; D360-R362 PolarHBondContact OD2-NE 2.82Å; D360-R362 IonicContact OD2-NH2 3.53Å; D360-R362 PolarHBondContact OD2-NH2 2.9Å; R362-L364 PolarHBondContact O-N 3.08Å; R362-A365 PolarHBondContact O-N 2.58Å; R362-A365 VanDerWaalsContact O-N 3.15Å; R362-S366 WeakPolarHBondContact O-CB 2.91Å; R362-S366 PolarHBondContact O-N 2.94Å
363	C	88.7	Confident	91.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-27.7	172.5	73.6	0	0	0	0	113.4	F346 V359 D360 H361 S366 I367 G368 Y369 L374	F346-C363 HydrophobicContact CB-CB 4.22Å; F346-C363 HydrophobicContact CD1-CB 4.35Å; F346-C363 HydrophobicContact CD2-CB 3.66Å; F346-C363 HydrophobicContact CE2-CB 4.08Å; F346-C363 HydrophobicContact CG-CB 3.81Å; V359-C363 HydrophobicContact CG1-CB 3.65Å; D360-C363 VanDerWaalsContact O-CB 3.31Å; D360-C363 WeakPolarHBondContact O-CB 3.16Å; D360-C363 PolarHBondContact O-N 3.31Å; D360-C363 PolarHBondContact O-SG 2.81Å; H361-C363 PolarHBondContact O-N 2.64Å; C363-S366 PolarHBondContact O-N 3.08Å; C363-I367 HydrophobicContact CB-CD1 4.22Å; C363-I367 HydrophobicContact CB-CG1 4.07Å; C363-I367 WeakPolarHBondContact O-CG1 3.28Å; C363-I367 PolarHBondContact O-N 3.03Å; C363-G368 PolarHBondContact O-N 3.01Å; C363-Y369 CarbonylContact C-O 3.57Å; C363-Y369 PolarHBondContact SG-O 3.08Å; C363-L374 HydrophobicContact CB-CD1 4.34Å
364	L	87.4	Confident	91.8	Very high	62 Å²	62	47.6 Å²	47.6	33%	0.325	25%	0.25	S	S	.	.	H	α-helix	trans	-65.1	-41.6	176.9	-177.3	63.6	0	0	0	111.8	H361 R362 G368 Y369 Q370	H361-L364 WeakPolarHBondContact O-CB 3.06Å; H361-L364 PolarHBondContact O-N 2.91Å; R362-L364 PolarHBondContact O-N 3.08Å; L364-G368 VanDerWaalsContact O-CA 3.24Å; L364-G368 WeakPolarHBondContact O-CA 3.2Å; L364-G368 PolarHBondContact O-N 3.02Å; L364-Y369 VanDerWaalsContact CA-O 3.25Å; L364-Y369 WeakPolarHBondContact CA-O 3.25Å; L364-Y369 PolarHBondContact N-O 3.43Å; L364-Q370 HydrophobicContact CD1-CG 4.23Å
365	A	83.4	Confident	92	Very high	86 Å²	86	50.9 Å²	50.9	71%	0.711	27%	0.267	S	S	*	.	H	α-helix	trans	-78.7	-27.7	175.8	0	0	0	0	0	112.8	R362	R362-A365 PolarHBondContact O-N 2.58Å; R362-A365 VanDerWaalsContact O-N 3.15Å
366	S	85.7	Confident	91.9	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-84.2	-44.5	-177.1	-172.7	0	0	0	0	113.8	V344 F346 R362 C363 M420 N446	V344-S366 WeakPolarHBondContact O-CB 3.5Å; V344-S366 PolarHBondContact O-OG 2.78Å; F346-S366 WeakPolarHBondContact CD1-OG 3.3Å; R362-S366 WeakPolarHBondContact O-CB 2.91Å; R362-S366 PolarHBondContact O-N 2.94Å; C363-S366 PolarHBondContact O-N 3.08Å; S366-M420 VanDerWaalsContact O-CE 3.28Å; S366-M420 WeakPolarHBondContact O-CE 3.19Å; S366-N446 PolarHBondContact O-ND2 2.77Å; S366-N446 PolarHBondContact OG-ND2 3.45Å; S366-N446 PolarHBondContact OG-OD1 3.3Å
367	I	91.4	Very high	91.8	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-131.1	1.4	-172.7	53.9	172	0	0	0	114.3	F346 C363 Y369 L374 F412 K415 M420 M422	F346-I367 HydrophobicContact CE1-CD1 3.96Å; F346-I367 HydrophobicContact CE1-CG1 4.21Å; F346-I367 HydrophobicContact CE1-CG2 4.05Å; F346-I367 HydrophobicContact CE2-CD1 4.21Å; F346-I367 HydrophobicContact CZ-CD1 3.59Å; F346-I367 HydrophobicContact CZ-CG1 4.32Å; C363-I367 HydrophobicContact CB-CD1 4.22Å; C363-I367 HydrophobicContact CB-CG1 4.07Å; C363-I367 WeakPolarHBondContact O-CG1 3.28Å; C363-I367 PolarHBondContact O-N 3.03Å; I367-Y369 HydrophobicContact CB-CD2 4.29Å; I367-Y369 HydrophobicContact CD1-CD2 4.05Å; I367-Y369 HydrophobicContact CG1-CD2 4.12Å; I367-Y369 WeakPolarHBondContact O-CD2 3.27Å; I367-Y369 PolarHBondContact O-N 2.89Å; I367-L374 HydrophobicContact CD1-CD1 3.79Å; I367-F412 HydrophobicContact CB-CD1 4.43Å; I367-F412 HydrophobicContact CB-CE1 4.09Å; I367-F412 HydrophobicContact CD1-CD1 4.49Å; I367-F412 HydrophobicContact CD1-CE1 3.57Å; I367-F412 HydrophobicContact CD1-CZ 3.63Å; I367-F412 HydrophobicContact CG1-CE1 4.41Å; I367-F412 HydrophobicContact CG2-CD1 3.91Å; I367-F412 HydrophobicContact CG2-CE1 3.98Å; I367-K415 PolarHBondContact O-N 2.93Å; I367-M420 HydrophobicContact CB-CE 4.42Å; I367-M420 HydrophobicContact CG2-CE 3.72Å; I367-M422 HydrophobicContact CG2-CE 3.62Å
368	G	89.8	Confident	91.9	Very high	30 Å²	30	52.1 Å²	52.1	31%	0.309	28%	0.281	S	S	.	.	S	Bend	trans	79.8	-8.1	175.7	0	0	0	0	0	115.6	C363 L364 K415	C363-G368 PolarHBondContact O-N 3.01Å; L364-G368 VanDerWaalsContact O-CA 3.24Å; L364-G368 WeakPolarHBondContact O-CA 3.2Å; L364-G368 PolarHBondContact O-N 3.02Å; G368-K415 WeakPolarHBondContact O-CD 3.38Å
369	Y	94.3	Very high	91.8	Very high	30 Å²	30	48.4 Å²	48.4	12%	0.118	27%	0.265	C	S	.	.			trans	-84.7	145.1	177.6	-68.9	-78.5	0	0	0	112.1	C363 L364 I367 E373 L374 F382 F412 R413 K415	C363-Y369 CarbonylContact C-O 3.57Å; C363-Y369 PolarHBondContact SG-O 3.08Å; L364-Y369 VanDerWaalsContact CA-O 3.25Å; L364-Y369 WeakPolarHBondContact CA-O 3.25Å; L364-Y369 PolarHBondContact N-O 3.43Å; I367-Y369 HydrophobicContact CB-CD2 4.29Å; I367-Y369 HydrophobicContact CD1-CD2 4.05Å; I367-Y369 HydrophobicContact CG1-CD2 4.12Å; I367-Y369 WeakPolarHBondContact O-CD2 3.27Å; I367-Y369 PolarHBondContact O-N 2.89Å; Y369-E373 WeakPolarHBondContact CA-OE2 2.98Å; Y369-E373 HydrophobicContact CD1-CB 4.01Å; Y369-L374 HydrophobicContact CD1-CD2 4.38Å; Y369-L374 HydrophobicContact CD2-CD2 4.02Å; Y369-L374 HydrophobicContact CG-CD2 3.9Å; Y369-L374 HydrophobicContact CG-CG 4.27Å; Y369-F382 HydrophobicContact CE1-CE1 4.09Å; Y369-F382 HydrophobicContact CE2-CD1 4.08Å; Y369-F382 HydrophobicContact CE2-CE1 4.05Å; Y369-F382 AromaticContact CZ-CE1 3.74Å; Y369-F412 HydrophobicContact CD2-CE1 4.45Å; Y369-F412 HydrophobicContact CE2-CE1 4.22Å; Y369-R413 WeakPolarHBondContact CE2-O 3.44Å; Y369-K415 HydrophobicContact CD1-CB 4.07Å; Y369-K415 HydrophobicContact CD1-CD 4.07Å; Y369-K415 HydrophobicContact CD1-CG 4.07Å; Y369-K415 HydrophobicContact CD2-CB 4.09Å; Y369-K415 HydrophobicContact CE1-CB 3.95Å; Y369-K415 HydrophobicContact CE1-CD 4.4Å; Y369-K415 HydrophobicContact CE1-CG 3.92Å; Y369-K415 HydrophobicContact CE2-CB 3.99Å; Y369-K415 VanDerWaalsContact CE2-N 3.33Å; Y369-K415 HydrophobicContact CG-CB 4.14Å
370	Q	92.6	Very high	91.9	Very high	69 Å²	69	48.9 Å²	48.9	32%	0.322	27%	0.267	S	S	.	.			trans	-76.7	150	161.6	-68.7	-71.7	9	0	0	109.9	H361 L364 Q372 E373	H361-Q370 PolarHBondContact CE1-OE1 2.94Å; L364-Q370 HydrophobicContact CD1-CG 4.23Å; Q370-Q372 PolarHBondContact O-N 2.97Å; Q370-Q372 VanDerWaalsContact O-N 3.14Å; Q370-E373 HydrophobicContact CB-CG 4.26Å; Q370-E373 PolarHBondContact N-OE2 2.93Å; Q370-E373 WeakPolarHBondContact O-CB 3.13Å; Q370-E373 PolarHBondContact O-N 3.12Å
371	P	93.1	Very high	92.4	Very high	13 Å²	13	51.4 Å²	51.4	8%	0.084	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-50.8	-40.1	177.9	-30.2	36.4	0	0	0	113.9	V359 E373 L374 L375	V359-P371 HydrophobicContact CB-CB 4.23Å; P371-E373 PolarHBondContact O-N 3.18Å; P371-L374 PolarHBondContact O-N 3.12Å; P371-L375 WeakPolarHBondContact O-CG 3.4Å; P371-L375 PolarHBondContact O-N 3.03Å
372	Q	94.9	Very high	93	Very high	143 Å²	143	46.3 Å²	46.3	67%	0.668	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-66	-16.8	179.2	-57.8	81.8	-1.6	0	0	113.5	Q370	Q370-Q372 PolarHBondContact O-N 2.97Å; Q370-Q372 VanDerWaalsContact O-N 3.14Å
373	E	95.7	Very high	93.5	Very high	61 Å²	61	41.8 Å²	41.8	29%	0.285	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-86.2	-11.2	174.9	-61.4	178.6	119.3	0	0	112.8	Y369 Q370 P371 K377 K415	Y369-E373 WeakPolarHBondContact CA-OE2 2.98Å; Y369-E373 HydrophobicContact CD1-CB 4.01Å; Q370-E373 HydrophobicContact CB-CG 4.26Å; Q370-E373 PolarHBondContact N-OE2 2.93Å; Q370-E373 WeakPolarHBondContact O-CB 3.13Å; Q370-E373 PolarHBondContact O-N 3.12Å; P371-E373 PolarHBondContact O-N 3.18Å; E373-K377 WeakPolarHBondContact O-CD 3.34Å; E373-K377 WeakPolarHBondContact O-CE 3.45Å; E373-K377 PolarHBondContact O-NZ 3.17Å; E373-K415 VanDerWaalsContact OE1-CE 3.32Å; E373-K415 WeakPolarHBondContact OE1-CE 3.5Å; E373-K415 IonicContact OE1-NZ 2.68Å; E373-K415 PolarHBondContact OE1-NZ 2.75Å; E373-K415 IonicContact OE2-NZ 2.69Å; E373-K415 PolarHBondContact OE2-NZ 3.39Å
374	L	96.8	Very high	93.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-39.7	-177.9	-62.3	171.6	0	0	0	112.2	F356 V359 C363 I367 Y369 P371 G376 K377 F382	F356-L374 WeakPolarHBondContact CB-O 3.33Å; F356-L374 HydrophobicContact CD2-CB 4.18Å; F356-L374 WeakPolarHBondContact CD2-O 3.23Å; F356-L374 HydrophobicContact CE2-CB 4.37Å; F356-L374 HydrophobicContact CE2-CD2 4.44Å; F356-L374 HydrophobicContact CG-CB 4.34Å; V359-L374 HydrophobicContact CG1-CD1 3.96Å; V359-L374 HydrophobicContact CG2-CB 3.98Å; V359-L374 HydrophobicContact CG2-CD1 4.26Å; C363-L374 HydrophobicContact CB-CD1 4.34Å; I367-L374 HydrophobicContact CD1-CD1 3.79Å; Y369-L374 HydrophobicContact CD1-CD2 4.38Å; Y369-L374 HydrophobicContact CD2-CD2 4.02Å; Y369-L374 HydrophobicContact CG-CD2 3.9Å; Y369-L374 HydrophobicContact CG-CG 4.27Å; P371-L374 PolarHBondContact O-N 3.12Å; L374-G376 PolarHBondContact O-N 2.88Å; L374-K377 WeakPolarHBondContact O-CB 3.49Å; L374-K377 PolarHBondContact O-N 3.35Å; L374-K377 VanDerWaalsContact O-N 3.15Å; L374-F382 HydrophobicContact CD2-CD1 4.13Å; L374-F382 HydrophobicContact CD2-CE1 3.55Å; L374-F382 HydrophobicContact CD2-CE2 4.04Å; L374-F382 HydrophobicContact CD2-CZ 3.5Å
375	L	97.4	Very high	94.3	Very high	71 Å²	71	44.5 Å²	44.5	37%	0.372	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	135.9	179.7	-73.2	168.5	0	0	0	112.4	T357 V359 P371 K377	T357-L375 VanDerWaalsContact C-CD2 3.49Å; T357-L375 WeakPolarHBondContact O-CD2 3.3Å; V359-L375 HydrophobicContact CG2-CD2 4.45Å; P371-L375 WeakPolarHBondContact O-CG 3.4Å; P371-L375 PolarHBondContact O-N 3.03Å; L375-K377 PolarHBondContact O-N 3.36Å
376	G	95.4	Very high	95	Very high	56 Å²	56	47 Å²	47	58%	0.577	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-0.8	-179.9	0	0	0	0	0	115.8	F356 L374	F356-G376 PolarHBondContact O-N 3.49Å; L374-G376 PolarHBondContact O-N 2.88Å
377	K	97.6	Very high	95.5	Very high	96 Å²	96	47.8 Å²	47.8	42%	0.417	26%	0.26	S	S	.	.	S	Bend	trans	-100.8	163.3	173.3	-61.2	174.4	-174.6	169.9	0	111	M355 F356 E373 L374 L375 F382	M355-K377 VanDerWaalsContact CA-O 3.28Å; M355-K377 WeakPolarHBondContact CA-O 3.39Å; F356-K377 WeakPolarHBondContact CD2-O 3.47Å; F356-K377 PolarHBondContact N-O 3.5Å; E373-K377 WeakPolarHBondContact O-CD 3.34Å; E373-K377 WeakPolarHBondContact O-CE 3.45Å; E373-K377 PolarHBondContact O-NZ 3.17Å; L374-K377 WeakPolarHBondContact O-CB 3.49Å; L374-K377 PolarHBondContact O-N 3.35Å; L374-K377 VanDerWaalsContact O-N 3.15Å; L375-K377 PolarHBondContact O-N 3.36Å; K377-F382 HydrophobicContact CB-CE2 3.94Å; K377-F382 HydrophobicContact CD-CE2 4.13Å; K377-F382 HydrophobicContact CD-CZ 3.88Å
378	N	97.3	Very high	95.7	Very high	33 Å²	33	50.8 Å²	50.8	18%	0.176	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-85	141.4	177.4	-157.2	-68	0	0	0	110.9	Q353 G354 L380 D381 F382	Q353-N378 PolarHBondContact O-ND2 3.45Å; G354-N378 CarbonylContact O-C 3.58Å; G354-N378 WeakPolarHBondContact O-CA 3.41Å; G354-N378 PolarHBondContact O-OD1 3.21Å; N378-L380 PolarHBondContact O-N 3.12Å; N378-L380 VanDerWaalsContact OD1-CB 3.26Å; N378-L380 WeakPolarHBondContact OD1-CB 3.41Å; N378-L380 WeakPolarHBondContact OD1-CD1 3.4Å; N378-L380 VanDerWaalsContact OD1-CG 3.24Å; N378-L380 WeakPolarHBondContact OD1-CG 3.15Å; N378-L380 PolarHBondContact OD1-N 3.24Å; N378-D381 WeakPolarHBondContact CB-OD2 3.37Å; N378-D381 PolarHBondContact N-OD2 2.99Å; N378-D381 VanDerWaalsContact O-CB 3.27Å; N378-D381 WeakPolarHBondContact O-CB 3.34Å; N378-D381 PolarHBondContact O-N 3.31Å; N378-F382 WeakPolarHBondContact O-CD2 3.39Å
379	I	96.5	Very high	96.1	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-58	-30.7	172.4	-164.6	175.2	0	0	0	111.9	G354 F356 D381 F382 S383 L391 F395 F410	G354-I379 PolarHBondContact O-N 2.85Å; F356-I379 HydrophobicContact CE2-CB 4.27Å; F356-I379 HydrophobicContact CE2-CG1 4.48Å; F356-I379 HydrophobicContact CZ-CB 4.34Å; F356-I379 HydrophobicContact CZ-CG1 4.13Å; I379-D381 PolarHBondContact O-N 2.95Å; I379-F382 PolarHBondContact O-N 2.87Å; I379-S383 PolarHBondContact O-N 2.92Å; I379-L391 HydrophobicContact CD1-CD2 4.31Å; I379-L391 HydrophobicContact CG1-CD2 4.18Å; I379-L391 HydrophobicContact CG2-CD2 4.12Å; I379-F395 HydrophobicContact CD1-CE2 4.21Å; I379-F395 HydrophobicContact CD1-CZ 4.15Å; I379-F395 HydrophobicContact CG2-CE2 4.12Å; I379-F395 HydrophobicContact CG2-CZ 4.03Å; I379-F410 HydrophobicContact CD1-CZ 4.1Å; I379-F410 HydrophobicContact CG1-CZ 4.37Å
380	L	96.1	Very high	96.2	Very high	18 Å²	18	54.3 Å²	54.3	9%	0.094	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-63.8	-25.4	176.2	-62.8	168.4	0	0	0	112.9	N378 F382 S383 Q388 L391	N378-L380 PolarHBondContact O-N 3.12Å; N378-L380 VanDerWaalsContact OD1-CB 3.26Å; N378-L380 WeakPolarHBondContact OD1-CB 3.41Å; N378-L380 WeakPolarHBondContact OD1-CD1 3.4Å; N378-L380 VanDerWaalsContact OD1-CG 3.24Å; N378-L380 WeakPolarHBondContact OD1-CG 3.15Å; N378-L380 PolarHBondContact OD1-N 3.24Å; L380-F382 PolarHBondContact O-N 3.15Å; L380-S383 WeakPolarHBondContact CA-OG 3.44Å; L380-S383 PolarHBondContact O-N 3.18Å; L380-S383 PolarHBondContact O-OG 3.45Å; L380-S383 VanDerWaalsContact O-OG 3.14Å; L380-Q388 HydrophobicContact CB-CG 4.47Å; L380-Q388 HydrophobicContact CD2-CB 4.19Å; L380-Q388 HydrophobicContact CD2-CG 4.2Å; L380-Q388 WeakPolarHBondContact CD2-O 3.48Å; L380-Q388 PolarHBondContact O-NE2 3.07Å; L380-L391 HydrophobicContact CD2-CB 4.03Å; L380-L391 HydrophobicContact CD2-CD2 4.14Å; L380-L391 HydrophobicContact CD2-CG 4.13Å
381	D	96.1	Very high	96.3	Very high	84 Å²	84	51.1 Å²	51.1	45%	0.449	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-68	-13.8	174	-56.3	-38.4	0	0	0	112.3	N378 I379 R413	N378-D381 WeakPolarHBondContact CB-OD2 3.37Å; N378-D381 PolarHBondContact N-OD2 2.99Å; N378-D381 VanDerWaalsContact O-CB 3.27Å; N378-D381 WeakPolarHBondContact O-CB 3.34Å; N378-D381 PolarHBondContact O-N 3.31Å; I379-D381 PolarHBondContact O-N 2.95Å; D381-R413 PolarHBondContact O-NH2 3.32Å
382	F	96.6	Very high	96.5	Very high	10 Å²	10	56.4 Å²	56.4	4%	0.044	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114	-15.3	-179.7	-59.5	-93.3	0	0	0	113.5	F356 Y369 L374 K377 N378 I379 L380 F412 R413	F356-F382 HydrophobicContact CE2-CD2 4.02Å; F356-F382 HydrophobicContact CE2-CE2 4.1Å; Y369-F382 HydrophobicContact CE1-CE1 4.09Å; Y369-F382 HydrophobicContact CE2-CD1 4.08Å; Y369-F382 HydrophobicContact CE2-CE1 4.05Å; Y369-F382 AromaticContact CZ-CE1 3.74Å; L374-F382 HydrophobicContact CD2-CD1 4.13Å; L374-F382 HydrophobicContact CD2-CE1 3.55Å; L374-F382 HydrophobicContact CD2-CE2 4.04Å; L374-F382 HydrophobicContact CD2-CZ 3.5Å; K377-F382 HydrophobicContact CB-CE2 3.94Å; K377-F382 HydrophobicContact CD-CE2 4.13Å; K377-F382 HydrophobicContact CD-CZ 3.88Å; N378-F382 WeakPolarHBondContact O-CD2 3.39Å; I379-F382 PolarHBondContact O-N 2.87Å; L380-F382 PolarHBondContact O-N 3.15Å; F382-F412 HydrophobicContact CB-CD2 4.02Å; F382-F412 HydrophobicContact CB-CE1 4.04Å; F382-F412 HydrophobicContact CB-CE2 3.49Å; F382-F412 VanDerWaalsContact CB-CE2 3.49Å; F382-F412 HydrophobicContact CB-CG 4.5Å; F382-F412 HydrophobicContact CB-CZ 3.49Å; F382-F412 VanDerWaalsContact CB-CZ 3.49Å; F382-F412 HydrophobicContact CD1-CE1 4.22Å; F382-F412 AromaticContact CD1-CZ 3.93Å; F382-F412 HydrophobicContact CD1-CZ 3.93Å; F382-F412 HydrophobicContact CG-CE1 4.41Å; F382-F412 HydrophobicContact CG-CE2 4.16Å; F382-F412 AromaticContact CG-CZ 3.78Å; F382-F412 HydrophobicContact CG-CZ 3.78Å; F382-F412 CarbonylContact O-C 3.56Å; F382-R413 WeakPolarHBondContact O-CB 3.28Å; F382-R413 PolarHBondContact O-N 3.48Å
383	S	96.7	Very high	96.6	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.021	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-78.2	154.3	172.6	59.9	0	0	0	0	113	I379 L380 Q388 R411	I379-S383 PolarHBondContact O-N 2.92Å; L380-S383 WeakPolarHBondContact CA-OG 3.44Å; L380-S383 PolarHBondContact O-N 3.18Å; L380-S383 PolarHBondContact O-OG 3.45Å; L380-S383 VanDerWaalsContact O-OG 3.14Å; S383-Q388 WeakPolarHBondContact OG-CG 3.24Å; S383-R411 CarbonylContact C-O 3.6Å; S383-R411 WeakPolarHBondContact CA-O 3.26Å
384	H	97.1	Very high	96.6	Very high	33 Å²	33	51.8 Å²	51.8	15%	0.153	28%	0.281	C	S	.	.			trans	-64.6	142	173.6	-169.2	-99.6	0	0	0	111.1	E386 D387 Q388 R411 W419	H384-E386 VanDerWaalsContact C-N 3.25Å; H384-E386 IonicContact CE1-OE1 2.75Å; H384-E386 IonicContact CE1-OE2 3.63Å; H384-E386 PolarHBondContact CE1-OE2 2.94Å; H384-E386 VanDerWaalsContact CE1-OE2 3.24Å; H384-E386 IonicContact ND1-OE2 2.77Å; H384-E386 PolarHBondContact ND1-OE2 3.32Å; H384-E386 PolarHBondContact O-N 3.47Å; H384-E386 VanDerWaalsContact O-N 3.14Å; H384-D387 HydrophobicContact CB-CB 4.49Å; H384-D387 WeakPolarHBondContact O-CA 3.45Å; H384-D387 PolarHBondContact O-N 2.85Å; H384-Q388 PolarHBondContact O-N 2.88Å; H384-R411 HydrophobicContact CB-CB 3.71Å; H384-R411 PolarHBondContact CE1-NH1 2.85Å; H384-R411 VanDerWaalsContact CE1-NH1 3.29Å; H384-R411 PolarHBondContact N-O 2.92Å; H384-R411 VanDerWaalsContact ND1-CZ 3.27Å; H384-R411 PolarHBondContact ND1-NH1 3.1Å; H384-R411 PolarHBondContact ND1-NH2 3.2Å; H384-W419 VanDerWaalsContact CA-CZ3 3.45Å; H384-W419 HydrophobicContact CB-CE3 4.01Å; H384-W419 HydrophobicContact CB-CH2 4.15Å; H384-W419 HydrophobicContact CB-CZ3 3.79Å; H384-W419 AromaticContact CD2-CD2 3.84Å; H384-W419 AromaticContact CD2-CE2 3.57Å; H384-W419 AromaticContact CD2-CZ2 3.68Å; H384-W419 AromaticContact CD2-NE1 3.95Å; H384-W419 VanDerWaalsContact N-CZ3 3.31Å
385	P	96.5	Very high	96.5	Very high	86 Å²	86	52.4 Å²	52.4	56%	0.558	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-35.2	-174.9	-29.2	36.6	0	0	0	114.9	D387 Q388	P385-D387 VanDerWaalsContact C-N 3.29Å; P385-D387 PolarHBondContact O-N 3.46Å; P385-Q388 PolarHBondContact O-N 3.09Å
386	E	97.1	Very high	96.4	Very high	140 Å²	140	52.5 Å²	52.5	65%	0.654	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-29.9	174.7	-63.9	166	177.4	0	0	112.9	H384 R411	H384-E386 VanDerWaalsContact C-N 3.25Å; H384-E386 IonicContact CE1-OE1 2.75Å; H384-E386 IonicContact CE1-OE2 3.63Å; H384-E386 PolarHBondContact CE1-OE2 2.94Å; H384-E386 VanDerWaalsContact CE1-OE2 3.24Å; H384-E386 IonicContact ND1-OE2 2.77Å; H384-E386 PolarHBondContact ND1-OE2 3.32Å; H384-E386 PolarHBondContact O-N 3.47Å; H384-E386 VanDerWaalsContact O-N 3.14Å; E386-R411 IonicContact OE2-CZ 2.69Å; E386-R411 IonicContact OE2-NH1 2.78Å; E386-R411 PolarHBondContact OE2-NH1 3.1Å; E386-R411 IonicContact OE2-NH2 3.4Å; E386-R411 PolarHBondContact OE2-NH2 2.96Å
387	D	96.8	Very high	96.4	Very high	22 Å²	22	54.3 Å²	54.3	12%	0.118	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-10.5	-176.6	-55.4	-20.4	0	0	0	112.3	H384 P385 G389 L390 L391 F410 R411	H384-D387 HydrophobicContact CB-CB 4.49Å; H384-D387 WeakPolarHBondContact O-CA 3.45Å; H384-D387 PolarHBondContact O-N 2.85Å; P385-D387 VanDerWaalsContact C-N 3.29Å; P385-D387 PolarHBondContact O-N 3.46Å; D387-G389 VanDerWaalsContact C-N 3.28Å; D387-G389 PolarHBondContact O-N 3.02Å; D387-L390 PolarHBondContact O-N 3.42Å; D387-L391 WeakPolarHBondContact O-CB 3.47Å; D387-L391 PolarHBondContact O-N 2.94Å; D387-F410 HydrophobicContact CB-CB 3.78Å; D387-R411 IonicContact OD1-CZ 3.67Å; D387-R411 IonicContact OD1-NE 3.52Å; D387-R411 IonicContact OD1-NH2 2.81Å; D387-R411 PolarHBondContact OD1-NH2 3.14Å; D387-R411 WeakPolarHBondContact OD2-CB 3.49Å; D387-R411 IonicContact OD2-CZ 3.85Å; D387-R411 PolarHBondContact OD2-N 3.45Å; D387-R411 IonicContact OD2-NE 3.22Å; D387-R411 PolarHBondContact OD2-NE 2.69Å; D387-R411 IonicContact OD2-NH2 3.18Å
388	Q	96.6	Very high	96.3	Very high	67 Å²	67	49.7 Å²	49.7	31%	0.313	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-30	-177.1	-81.2	178.9	-9.2	0	0	113.6	L380 S383 H384 P385 R392	L380-Q388 HydrophobicContact CB-CG 4.47Å; L380-Q388 HydrophobicContact CD2-CB 4.19Å; L380-Q388 HydrophobicContact CD2-CG 4.2Å; L380-Q388 WeakPolarHBondContact CD2-O 3.48Å; L380-Q388 PolarHBondContact O-NE2 3.07Å; S383-Q388 WeakPolarHBondContact OG-CG 3.24Å; H384-Q388 PolarHBondContact O-N 2.88Å; P385-Q388 PolarHBondContact O-N 3.09Å; Q388-R392 WeakPolarHBondContact O-CB 3.35Å; Q388-R392 PolarHBondContact O-N 3.47Å
389	G	96.5	Very high	96.2	Very high	37 Å²	37	50.2 Å²	50.2	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-66.1	-59.4	173.2	0	0	0	0	0	110.9	D387 L391 R392 D393	D387-G389 VanDerWaalsContact C-N 3.28Å; D387-G389 PolarHBondContact O-N 3.02Å; G389-L391 VanDerWaalsContact C-N 3.26Å; G389-L391 PolarHBondContact O-N 2.88Å; G389-R392 WeakPolarHBondContact O-CB 3.17Å; G389-R392 PolarHBondContact O-N 2.73Å; G389-D393 PolarHBondContact O-N 3.08Å
390	L	96.3	Very high	96.1	Very high	97 Å²	97	57.7 Å²	57.7	51%	0.508	30%	0.295	S	S	.	.	H	α-helix	trans	-53.7	-40.5	178.6	-179.2	65.8	0	0	0	113	D387 S394 V408	D387-L390 PolarHBondContact O-N 3.42Å; L390-S394 WeakPolarHBondContact O-CB 3.43Å; L390-S394 PolarHBondContact O-N 3.35Å; L390-V408 HydrophobicContact CD2-CG2 4.06Å; L390-V408 HydrophobicContact CG-CG2 3.88Å
391	L	96.2	Very high	95.9	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-70.6	-36.4	178.3	-173.2	57	0	0	0	112.3	I379 L380 D387 G389 F395 V408 F410	I379-L391 HydrophobicContact CD1-CD2 4.31Å; I379-L391 HydrophobicContact CG1-CD2 4.18Å; I379-L391 HydrophobicContact CG2-CD2 4.12Å; L380-L391 HydrophobicContact CD2-CB 4.03Å; L380-L391 HydrophobicContact CD2-CD2 4.14Å; L380-L391 HydrophobicContact CD2-CG 4.13Å; D387-L391 WeakPolarHBondContact O-CB 3.47Å; D387-L391 PolarHBondContact O-N 2.94Å; G389-L391 VanDerWaalsContact C-N 3.26Å; G389-L391 PolarHBondContact O-N 2.88Å; L391-F395 HydrophobicContact CD1-CD2 4.07Å; L391-F395 HydrophobicContact CD1-CE2 3.91Å; L391-F395 HydrophobicContact CG-CD2 4.46Å; L391-F395 HydrophobicContact CG-CE2 4.49Å; L391-F395 WeakPolarHBondContact O-CD2 3.3Å; L391-F395 PolarHBondContact O-N 3.37Å; L391-F395 VanDerWaalsContact O-N 3.14Å; L391-V408 HydrophobicContact CD1-CG1 3.79Å; L391-F410 HydrophobicContact CD1-CD1 3.97Å; L391-F410 HydrophobicContact CD1-CE1 3.87Å; L391-F410 HydrophobicContact CD1-CZ 4.39Å; L391-F410 HydrophobicContact CD2-CD1 4.24Å; L391-F410 HydrophobicContact CD2-CD2 3.93Å; L391-F410 HydrophobicContact CD2-CE1 4.06Å; L391-F410 HydrophobicContact CD2-CE2 3.73Å; L391-F410 HydrophobicContact CD2-CG 4.18Å; L391-F410 HydrophobicContact CD2-CZ 3.8Å
392	R	96.3	Very high	95.4	Very high	125 Å²	125	61.1 Å²	61.1	47%	0.472	31%	0.307	S	S	.	.	H	α-helix	trans	-65.8	-48.5	173.4	-174.3	-169.8	-49.8	-73.5	-4.6	111.3	Q388 G389 S394 F395 D396	Q388-R392 WeakPolarHBondContact O-CB 3.35Å; Q388-R392 PolarHBondContact O-N 3.47Å; G389-R392 WeakPolarHBondContact O-CB 3.17Å; G389-R392 PolarHBondContact O-N 2.73Å; R392-S394 PolarHBondContact O-N 3.05Å; R392-F395 PolarHBondContact O-N 2.99Å; R392-D396 PolarHBondContact O-N 2.9Å
393	D	96.4	Very high	94.9	Very high	99 Å²	99	62.1 Å²	62.1	53%	0.529	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-37.9	180	-62.7	-24.1	0	0	0	111.1	G389 D396 Q397	G389-D393 PolarHBondContact O-N 3.08Å; D393-D396 PolarHBondContact O-N 3.43Å; D393-Q397 VanDerWaalsContact O-CB 3.22Å; D393-Q397 WeakPolarHBondContact O-CB 3.35Å; D393-Q397 PolarHBondContact O-N 2.95Å
394	S	96.1	Very high	94.7	Very high	8 Å²	8	68.2 Å²	68.2	6%	0.056	35%	0.349	C	S	.	.	H	α-helix	trans	-62.4	-42.9	172.5	-177.6	0	0	0	0	112.9	L390 R392 Q397 V398 L406	L390-S394 WeakPolarHBondContact O-CB 3.43Å; L390-S394 PolarHBondContact O-N 3.35Å; R392-S394 PolarHBondContact O-N 3.05Å; S394-Q397 PolarHBondContact O-N 3.24Å; S394-V398 PolarHBondContact O-N 3.01Å; S394-L406 WeakPolarHBondContact O-CD2 3.46Å
395	F	95.5	Very high	94.6	Very high	12 Å²	12	71.2 Å²	71.2	5%	0.053	37%	0.369	C	S	.	.	H	α-helix	trans	-66.9	-40.7	175.4	-92.2	-109.5	0	0	0	112.3	H350 I379 L391 R392 Q397 V398 V399 I440	H350-F395 HydrophobicContact CB-CE1 3.86Å; H350-F395 HydrophobicContact CB-CZ 4.48Å; H350-F395 AromaticContact CG-CE1 3.93Å; I379-F395 HydrophobicContact CD1-CE2 4.21Å; I379-F395 HydrophobicContact CD1-CZ 4.15Å; I379-F395 HydrophobicContact CG2-CE2 4.12Å; I379-F395 HydrophobicContact CG2-CZ 4.03Å; L391-F395 HydrophobicContact CD1-CD2 4.07Å; L391-F395 HydrophobicContact CD1-CE2 3.91Å; L391-F395 HydrophobicContact CG-CD2 4.46Å; L391-F395 HydrophobicContact CG-CE2 4.49Å; L391-F395 WeakPolarHBondContact O-CD2 3.3Å; L391-F395 PolarHBondContact O-N 3.37Å; L391-F395 VanDerWaalsContact O-N 3.14Å; R392-F395 PolarHBondContact O-N 2.99Å; F395-Q397 VanDerWaalsContact C-N 3.28Å; F395-Q397 PolarHBondContact O-N 3Å; F395-V398 WeakPolarHBondContact O-CG1 3.41Å; F395-V399 WeakPolarHBondContact O-CG2 3.34Å; F395-V399 PolarHBondContact O-N 2.9Å; F395-I440 HydrophobicContact CD1-CD1 3.48Å; F395-I440 VanDerWaalsContact CD1-CD1 3.48Å; F395-I440 HydrophobicContact CE1-CD1 3.85Å; F395-I440 HydrophobicContact CE1-CG2 4.37Å; F395-I440 HydrophobicContact CG-CD1 4.4Å
396	D	95.3	Very high	94.6	Very high	73 Å²	73	68.7 Å²	68.7	39%	0.39	35%	0.35	S	S	.	.	H	α-helix	trans	-67.7	-28.6	174	-79	-10	0	0	0	112.4	R392 D393 K400	R392-D396 PolarHBondContact O-N 2.9Å; D393-D396 PolarHBondContact O-N 3.43Å; D396-K400 WeakPolarHBondContact O-CD 3.17Å; D396-K400 WeakPolarHBondContact O-CE 3.34Å; D396-K400 VanDerWaalsContact O-CG 3.32Å; D396-K400 WeakPolarHBondContact O-CG 3.33Å; D396-K400 PolarHBondContact O-NZ 3.29Å
397	Q	95.9	Very high	94.5	Very high	94 Å²	94	65.3 Å²	65.3	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-78.5	-42.3	177.1	-172.6	177	10.3	0	0	112	D393 S394 F395 V399 K400 L401 L406	D393-Q397 VanDerWaalsContact O-CB 3.22Å; D393-Q397 WeakPolarHBondContact O-CB 3.35Å; D393-Q397 PolarHBondContact O-N 2.95Å; S394-Q397 PolarHBondContact O-N 3.24Å; F395-Q397 VanDerWaalsContact C-N 3.28Å; F395-Q397 PolarHBondContact O-N 3Å; Q397-V399 PolarHBondContact O-N 2.88Å; Q397-K400 WeakPolarHBondContact O-CB 3.22Å; Q397-K400 PolarHBondContact O-N 3.48Å; Q397-L401 HydrophobicContact CG-CD1 3.82Å; Q397-L401 HydrophobicContact CG-CG 4.1Å; Q397-L401 WeakPolarHBondContact O-CB 3.32Å; Q397-L401 WeakPolarHBondContact O-CG 3.4Å; Q397-L401 PolarHBondContact O-N 3.36Å; Q397-L406 HydrophobicContact CB-CD2 3.71Å; Q397-L406 HydrophobicContact CG-CD2 3.82Å
398	V	95.6	Very high	94.5	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-67.2	-24.4	179.6	79.2	0	0	0	0	113.2	S394 F395 L406 S426 F427 T428 I440	S394-V398 PolarHBondContact O-N 3.01Å; F395-V398 WeakPolarHBondContact O-CG1 3.41Å; V398-L406 HydrophobicContact CB-CB 4.36Å; V398-L406 HydrophobicContact CB-CD2 4.46Å; V398-L406 HydrophobicContact CG2-CB 4.31Å; V398-S426 WeakPolarHBondContact CG2-O 3.46Å; V398-F427 VanDerWaalsContact CG2-CA 3.44Å; V398-T428 WeakPolarHBondContact O-CG2 3.44Å; V398-T428 PolarHBondContact O-OG1 3.4Å; V398-I440 HydrophobicContact CG1-CD1 3.91Å; V398-I440 HydrophobicContact CG1-CG1 4.18Å; V398-I440 HydrophobicContact CG1-CG2 3.92Å
399	V	94.2	Very high	94.5	Very high	43 Å²	43	65.8 Å²	65.8	26%	0.261	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-43.4	168	170.3	0	0	0	0	111.5	C352 F395 Q397 T428 I437 I440	C352-V399 HydrophobicContact CB-CG2 4.36Å; F395-V399 WeakPolarHBondContact O-CG2 3.34Å; F395-V399 PolarHBondContact O-N 2.9Å; Q397-V399 PolarHBondContact O-N 2.88Å; V399-T428 HydrophobicContact CG2-CG2 4.29Å; V399-I437 HydrophobicContact CG1-CD1 4.01Å; V399-I440 HydrophobicContact CG2-CD1 4.02Å
400	K	93.9	Very high	94.5	Very high	159 Å²	159	64.1 Å²	64.1	69%	0.691	33%	0.328	S	S	*	.	H	α-helix	trans	-70.6	-31.2	178.5	-65.3	159.8	-166.9	154.3	0	112.7	D396 Q397 K402	D396-K400 WeakPolarHBondContact O-CD 3.17Å; D396-K400 WeakPolarHBondContact O-CE 3.34Å; D396-K400 VanDerWaalsContact O-CG 3.32Å; D396-K400 WeakPolarHBondContact O-CG 3.33Å; D396-K400 PolarHBondContact O-NZ 3.29Å; Q397-K400 WeakPolarHBondContact O-CB 3.22Å; Q397-K400 PolarHBondContact O-N 3.48Å; K400-K402 VanDerWaalsContact C-N 3.27Å; K400-K402 PolarHBondContact O-N 2.99Å
401	L	92.4	Very high	94.5	Very high	54 Å²	54	63.1 Å²	63.1	28%	0.283	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	5.1	-177.3	-71.4	178.5	0	0	0	115	Q397 G403 Q404 L406	Q397-L401 HydrophobicContact CG-CD1 3.82Å; Q397-L401 HydrophobicContact CG-CG 4.1Å; Q397-L401 WeakPolarHBondContact O-CB 3.32Å; Q397-L401 WeakPolarHBondContact O-CG 3.4Å; Q397-L401 PolarHBondContact O-N 3.36Å; L401-G403 PolarHBondContact O-N 3.38Å; L401-Q404 HydrophobicContact CB-CB 4.23Å; L401-Q404 WeakPolarHBondContact O-CG 3.37Å; L401-Q404 PolarHBondContact O-N 2.92Å; L401-L406 HydrophobicContact CD1-CB 4.34Å; L401-L406 HydrophobicContact CD1-CD1 4.39Å; L401-L406 HydrophobicContact CD1-CD2 4.49Å
402	K	85.6	Confident	94.5	Very high	121 Å²	121	63.1 Å²	63.1	53%	0.526	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	34.8	65.4	169.6	-83.9	-165.3	161.8	-122.4	0	114.7	K400 Q430	K400-K402 VanDerWaalsContact C-N 3.27Å; K400-K402 PolarHBondContact O-N 2.99Å; K402-Q430 VanDerWaalsContact C-NE2 3.31Å; K402-Q430 PolarHBondContact O-NE2 3.23Å
403	G	85.8	Confident	94.5	Very high	31 Å²	31	61.9 Å²	61.9	32%	0.32	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-9.9	174.8	0	0	0	0	0	116.4	L401 T428	L401-G403 PolarHBondContact O-N 3.38Å; G403-T428 WeakPolarHBondContact CA-O 3.44Å; G403-T428 PolarHBondContact N-OG1 3.42Å
404	Q	92.7	Very high	94.4	Very high	131 Å²	131	57.4 Å²	57.4	61%	0.612	29%	0.289	S	S	*	.			trans	-68.7	146.3	167.8	-57.6	179.9	-1.3	0	0	110.7	L401	L401-Q404 HydrophobicContact CB-CB 4.23Å; L401-Q404 WeakPolarHBondContact O-CG 3.37Å; L401-Q404 PolarHBondContact O-N 2.92Å
405	V	95.1	Very high	94.3	Very high	95 Å²	95	61.4 Å²	61.4	58%	0.576	31%	0.306	S	S	*	.			trans	-84.1	120.2	-177.8	-175.8	0	0	0	0	110.8	S426 F427	V405-S426 CarbonylContact C-O 3.59Å; V405-S426 WeakPolarHBondContact CA-O 3.41Å; V405-F427 HydrophobicContact CG2-CB 4.1Å; V405-F427 HydrophobicContact CG2-CD1 4.26Å; V405-F427 HydrophobicContact CG2-CG 4.39Å
406	L	96.1	Very high	94.1	Very high	33 Å²	33	65.3 Å²	65.3	17%	0.173	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	144.7	170.2	-172.7	63.5	0	0	0	109.5	S394 Q397 V398 L401 S425 S426	S394-L406 WeakPolarHBondContact O-CD2 3.46Å; Q397-L406 HydrophobicContact CB-CD2 3.71Å; Q397-L406 HydrophobicContact CG-CD2 3.82Å; V398-L406 HydrophobicContact CB-CB 4.36Å; V398-L406 HydrophobicContact CB-CD2 4.46Å; V398-L406 HydrophobicContact CG2-CB 4.31Å; L401-L406 HydrophobicContact CD1-CB 4.34Å; L401-L406 HydrophobicContact CD1-CD1 4.39Å; L401-L406 HydrophobicContact CD1-CD2 4.49Å; L406-S425 CarbonylContact O-C 3.51Å; L406-S425 WeakPolarHBondContact O-CA 3.04Å; L406-S426 PolarHBondContact N-O 3.47Å; L406-S426 PolarHBondContact O-N 3.24Å; L406-S426 PolarHBondContact O-OG 3.29Å
407	S	96	Very high	93.9	Very high	69 Å²	69	71.7 Å²	71.7	48%	0.483	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.7	179	-63.9	0	0	0	0	111.4	T424 S425	S407-T424 WeakPolarHBondContact CA-O 3.42Å; S407-S425 WeakPolarHBondContact OG-CB 3.27Å; S407-S425 PolarHBondContact OG-OG 3.3Å
408	V	96.6	Very high	93.7	Very high	11 Å²	11	73.1 Å²	73.1	7%	0.067	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146.7	179	61.8	0	0	0	0	110.3	L390 L391 F410 R423 T424	L390-V408 HydrophobicContact CD2-CG2 4.06Å; L390-V408 HydrophobicContact CG-CG2 3.88Å; L391-V408 HydrophobicContact CD1-CG1 3.79Å; V408-F410 HydrophobicContact CG1-CD1 4.35Å; V408-R423 WeakPolarHBondContact O-CA 3.25Å; V408-T424 PolarHBondContact N-O 3.37Å; V408-T424 PolarHBondContact O-N 2.87Å
409	M	95.9	Very high	93.6	Very high	88 Å²	88	78.3 Å²	78.3	43%	0.433	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134	167.8	-70.4	-174.9	-176.7	0	0	109.7	L421 M422 R423	M409-L421 HydrophobicContact CB-CD1 4.34Å; M409-M422 VanDerWaalsContact CA-O 3.31Å; M409-M422 WeakPolarHBondContact CA-O 3.33Å; M409-R423 HydrophobicContact CE-CG 4.39Å; M409-R423 HydrophobicContact CG-CB 4.23Å; M409-R423 HydrophobicContact CG-CG 4.23Å
410	F	96.6	Very high	93.5	Very high	3 Å²	3	78.7 Å²	78.7	1%	0.013	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	164.9	175.4	68.9	-80.2	0	0	0	111.2	I379 D387 L391 V408 F412 M422	I379-F410 HydrophobicContact CD1-CZ 4.1Å; I379-F410 HydrophobicContact CG1-CZ 4.37Å; D387-F410 HydrophobicContact CB-CB 3.78Å; L391-F410 HydrophobicContact CD1-CD1 3.97Å; L391-F410 HydrophobicContact CD1-CE1 3.87Å; L391-F410 HydrophobicContact CD1-CZ 4.39Å; L391-F410 HydrophobicContact CD2-CD1 4.24Å; L391-F410 HydrophobicContact CD2-CD2 3.93Å; L391-F410 HydrophobicContact CD2-CE1 4.06Å; L391-F410 HydrophobicContact CD2-CE2 3.73Å; L391-F410 HydrophobicContact CD2-CG 4.18Å; L391-F410 HydrophobicContact CD2-CZ 3.8Å; V408-F410 HydrophobicContact CG1-CD1 4.35Å; F410-F412 HydrophobicContact CE2-CB 3.97Å; F410-F412 AromaticContact CE2-CD2 3.77Å; F410-F412 HydrophobicContact CE2-CD2 3.77Å; F410-F412 HydrophobicContact CE2-CG 4.36Å; F410-F412 AromaticContact CZ-CD2 3.95Å; F410-F412 HydrophobicContact CZ-CD2 3.95Å; F410-M422 HydrophobicContact CE1-CG 4.48Å; F410-M422 HydrophobicContact CZ-SD 4.18Å; F410-M422 PolarHBondContact N-O 3.34Å; F410-M422 PolarHBondContact O-N 2.85Å
411	R	96.8	Very high	93.5	Very high	75 Å²	75	74 Å²	74	28%	0.283	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	111.8	173.7	-71.3	161.6	-75.4	-174.9	-9.4	109.8	S383 H384 E386 D387 W419 M420	S383-R411 CarbonylContact C-O 3.6Å; S383-R411 WeakPolarHBondContact CA-O 3.26Å; H384-R411 HydrophobicContact CB-CB 3.71Å; H384-R411 PolarHBondContact CE1-NH1 2.85Å; H384-R411 VanDerWaalsContact CE1-NH1 3.29Å; H384-R411 PolarHBondContact N-O 2.92Å; H384-R411 VanDerWaalsContact ND1-CZ 3.27Å; H384-R411 PolarHBondContact ND1-NH1 3.1Å; H384-R411 PolarHBondContact ND1-NH2 3.2Å; E386-R411 IonicContact OE2-CZ 2.69Å; E386-R411 IonicContact OE2-NH1 2.78Å; E386-R411 PolarHBondContact OE2-NH1 3.1Å; E386-R411 IonicContact OE2-NH2 3.4Å; E386-R411 PolarHBondContact OE2-NH2 2.96Å; D387-R411 IonicContact OD1-CZ 3.67Å; D387-R411 IonicContact OD1-NE 3.52Å; D387-R411 IonicContact OD1-NH2 2.81Å; D387-R411 PolarHBondContact OD1-NH2 3.14Å; D387-R411 WeakPolarHBondContact OD2-CB 3.49Å; D387-R411 IonicContact OD2-CZ 3.85Å; D387-R411 PolarHBondContact OD2-N 3.45Å; D387-R411 IonicContact OD2-NE 3.22Å; D387-R411 PolarHBondContact OD2-NE 2.69Å; D387-R411 IonicContact OD2-NH2 3.18Å; R411-W419 HydrophobicContact CB-CB 4.34Å; R411-W419 HydrophobicContact CB-CE3 4.06Å; R411-M420 CarbonylContact C-O 3.53Å; R411-M420 WeakPolarHBondContact CA-O 3.3Å
412	F	96.6	Very high	93.6	Very high	2 Å²	2	71.5 Å²	71.5	1%	0.009	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	134.8	173.3	-169.2	-78.9	0	0	0	110.3	F356 I367 Y369 F382 F410 A414 M420 M422	F356-F412 HydrophobicContact CZ-CE2 4.44Å; I367-F412 HydrophobicContact CB-CD1 4.43Å; I367-F412 HydrophobicContact CB-CE1 4.09Å; I367-F412 HydrophobicContact CD1-CD1 4.49Å; I367-F412 HydrophobicContact CD1-CE1 3.57Å; I367-F412 HydrophobicContact CD1-CZ 3.63Å; I367-F412 HydrophobicContact CG1-CE1 4.41Å; I367-F412 HydrophobicContact CG2-CD1 3.91Å; I367-F412 HydrophobicContact CG2-CE1 3.98Å; Y369-F412 HydrophobicContact CD2-CE1 4.45Å; Y369-F412 HydrophobicContact CE2-CE1 4.22Å; F382-F412 HydrophobicContact CB-CD2 4.02Å; F382-F412 HydrophobicContact CB-CE1 4.04Å; F382-F412 HydrophobicContact CB-CE2 3.49Å; F382-F412 VanDerWaalsContact CB-CE2 3.49Å; F382-F412 HydrophobicContact CB-CG 4.5Å; F382-F412 HydrophobicContact CB-CZ 3.49Å; F382-F412 VanDerWaalsContact CB-CZ 3.49Å; F382-F412 HydrophobicContact CD1-CE1 4.22Å; F382-F412 AromaticContact CD1-CZ 3.93Å; F382-F412 HydrophobicContact CD1-CZ 3.93Å; F382-F412 HydrophobicContact CG-CE1 4.41Å; F382-F412 HydrophobicContact CG-CE2 4.16Å; F382-F412 AromaticContact CG-CZ 3.78Å; F382-F412 HydrophobicContact CG-CZ 3.78Å; F382-F412 CarbonylContact O-C 3.56Å; F410-F412 HydrophobicContact CE2-CB 3.97Å; F410-F412 AromaticContact CE2-CD2 3.77Å; F410-F412 HydrophobicContact CE2-CD2 3.77Å; F410-F412 HydrophobicContact CE2-CG 4.36Å; F410-F412 AromaticContact CZ-CD2 3.95Å; F410-F412 HydrophobicContact CZ-CD2 3.95Å; F412-A414 PolarHBondContact O-N 2.79Å; F412-M420 PolarHBondContact N-O 2.92Å; F412-M420 PolarHBondContact O-N 3.41Å; F412-M422 HydrophobicContact CB-CB 3.98Å; F412-M422 HydrophobicContact CB-CE 3.88Å; F412-M422 HydrophobicContact CB-SD 3.92Å; F412-M422 HydrophobicContact CD1-CE 4.22Å; F412-M422 HydrophobicContact CD2-CE 4.12Å; F412-M422 HydrophobicContact CD2-SD 3.72Å; F412-M422 HydrophobicContact CG-CE 3.81Å; F412-M422 HydrophobicContact CG-SD 3.93Å
413	R	96.3	Very high	94	Very high	99 Å²	99	71.4 Å²	71.4	37%	0.374	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	107.5	176.8	-176	165.2	57.3	176	-3.6	110.4	Y369 D381 F382 E418 W419	Y369-R413 WeakPolarHBondContact CE2-O 3.44Å; D381-R413 PolarHBondContact O-NH2 3.32Å; F382-R413 WeakPolarHBondContact O-CB 3.28Å; F382-R413 PolarHBondContact O-N 3.48Å; R413-E418 WeakPolarHBondContact CA-O 3.4Å; R413-W419 HydrophobicContact CB-CE3 3.89Å; R413-W419 HydrophobicContact CB-CH2 3.93Å; R413-W419 HydrophobicContact CB-CZ3 3.54Å; R413-W419 HydrophobicContact CG-CH2 4.44Å; R413-W419 HydrophobicContact CG-CZ3 4.43Å
414	A	93.6	Very high	94.5	Very high	4 Å²	4	69.9 Å²	69.9	3%	0.033	33%	0.325	C	S	.	.			trans	-66.2	165.4	173.1	0	0	0	0	0	111.8	F412 T416 R417 E418 M420	F412-A414 PolarHBondContact O-N 2.79Å; A414-T416 PolarHBondContact O-N 3.35Å; A414-R417 VanDerWaalsContact O-CA 3.32Å; A414-R417 WeakPolarHBondContact O-CA 3.47Å; A414-R417 PolarHBondContact O-N 3.11Å; A414-E418 PolarHBondContact N-O 3.17Å; A414-M420 HydrophobicContact CB-CE 3.89Å; A414-M420 HydrophobicContact CB-CG 4.33Å; A414-M420 HydrophobicContact CB-SD 4.19Å
415	K	93.7	Very high	94.7	Very high	92 Å²	92	65.3 Å²	65.3	40%	0.4	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.1	176.7	-167.8	173.1	-172.4	169	0	113.5	I367 G368 Y369 E373 R417	I367-K415 PolarHBondContact O-N 2.93Å; G368-K415 WeakPolarHBondContact O-CD 3.38Å; Y369-K415 HydrophobicContact CD1-CB 4.07Å; Y369-K415 HydrophobicContact CD1-CD 4.07Å; Y369-K415 HydrophobicContact CD1-CG 4.07Å; Y369-K415 HydrophobicContact CD2-CB 4.09Å; Y369-K415 HydrophobicContact CE1-CB 3.95Å; Y369-K415 HydrophobicContact CE1-CD 4.4Å; Y369-K415 HydrophobicContact CE1-CG 3.92Å; Y369-K415 HydrophobicContact CE2-CB 3.99Å; Y369-K415 VanDerWaalsContact CE2-N 3.33Å; Y369-K415 HydrophobicContact CG-CB 4.14Å; E373-K415 VanDerWaalsContact OE1-CE 3.32Å; E373-K415 WeakPolarHBondContact OE1-CE 3.5Å; E373-K415 IonicContact OE1-NZ 2.68Å; E373-K415 PolarHBondContact OE1-NZ 2.75Å; E373-K415 IonicContact OE2-NZ 2.69Å; E373-K415 PolarHBondContact OE2-NZ 3.39Å; K415-R417 PolarHBondContact O-N 2.81Å
416	T	91.4	Very high	94.8	Very high	95 Å²	95	60.8 Å²	60.8	58%	0.583	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-9	169.3	55.2	0	0	0	0	113.6	A414 E418	A414-T416 PolarHBondContact O-N 3.35Å; T416-E418 WeakPolarHBondContact CB-OE2 3.49Å; T416-E418 PolarHBondContact OG1-N 2.88Å; T416-E418 PolarHBondContact OG1-OE2 3.46Å
417	R	90.9	Very high	94.8	Very high	207 Å²	207	62.3 Å²	62.3	78%	0.781	29%	0.285	S	S	*	.	S	Bend	trans	71	7.6	-169.2	-52.1	-179	174.4	-165.1	-1.9	115	A414 K415	A414-R417 VanDerWaalsContact O-CA 3.32Å; A414-R417 WeakPolarHBondContact O-CA 3.47Å; A414-R417 PolarHBondContact O-N 3.11Å; K415-R417 PolarHBondContact O-N 2.81Å
418	E	92.7	Very high	94.8	Very high	123 Å²	123	59.1 Å²	59.1	58%	0.575	26%	0.263	S	S	*	.			trans	-75.8	150.7	172.2	-64.2	163.3	130.9	0	0	110.9	R413 A414 T416	R413-E418 WeakPolarHBondContact CA-O 3.4Å; A414-E418 PolarHBondContact N-O 3.17Å; T416-E418 WeakPolarHBondContact CB-OE2 3.49Å; T416-E418 PolarHBondContact OG1-N 2.88Å; T416-E418 PolarHBondContact OG1-OE2 3.46Å
419	W	93.5	Very high	94.8	Very high	109 Å²	109	61.8 Å²	61.8	41%	0.413	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	116.8	176.2	-64.8	108.8	0	0	0	109.7	H384 R411 R413	H384-W419 VanDerWaalsContact CA-CZ3 3.45Å; H384-W419 HydrophobicContact CB-CE3 4.01Å; H384-W419 HydrophobicContact CB-CH2 4.15Å; H384-W419 HydrophobicContact CB-CZ3 3.79Å; H384-W419 AromaticContact CD2-CD2 3.84Å; H384-W419 AromaticContact CD2-CE2 3.57Å; H384-W419 AromaticContact CD2-CZ2 3.68Å; H384-W419 AromaticContact CD2-NE1 3.95Å; H384-W419 VanDerWaalsContact N-CZ3 3.31Å; R411-W419 HydrophobicContact CB-CB 4.34Å; R411-W419 HydrophobicContact CB-CE3 4.06Å; R413-W419 HydrophobicContact CB-CE3 3.89Å; R413-W419 HydrophobicContact CB-CH2 3.93Å; R413-W419 HydrophobicContact CB-CZ3 3.54Å; R413-W419 HydrophobicContact CG-CH2 4.44Å; R413-W419 HydrophobicContact CG-CZ3 4.43Å
420	M	91.5	Very high	94.7	Very high	52 Å²	52	60 Å²	60	26%	0.256	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.4	177.4	-58.5	-166.5	-51.8	0	0	110.1	S366 I367 R411 F412 A414 M422	S366-M420 VanDerWaalsContact O-CE 3.28Å; S366-M420 WeakPolarHBondContact O-CE 3.19Å; I367-M420 HydrophobicContact CB-CE 4.42Å; I367-M420 HydrophobicContact CG2-CE 3.72Å; R411-M420 CarbonylContact C-O 3.53Å; R411-M420 WeakPolarHBondContact CA-O 3.3Å; F412-M420 PolarHBondContact N-O 2.92Å; F412-M420 PolarHBondContact O-N 3.41Å; A414-M420 HydrophobicContact CB-CE 3.89Å; A414-M420 HydrophobicContact CB-CG 4.33Å; A414-M420 HydrophobicContact CB-SD 4.19Å; M420-M422 PolarHBondContact O-N 2.99Å
421	L	93.6	Very high	94.5	Very high	61 Å²	61	61.5 Å²	61.5	32%	0.319	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	116.9	174.7	-175	62.2	0	0	0	109.1	M409 V447	M409-L421 HydrophobicContact CB-CD1 4.34Å; L421-V447 HydrophobicContact CB-CB 4.2Å; L421-V447 HydrophobicContact CD2-CB 4.04Å; L421-V447 HydrophobicContact CD2-CG1 3.94Å; L421-V447 HydrophobicContact CG-CB 3.97Å; L421-V447 HydrophobicContact CG-CG1 4.43Å; L421-V447 HydrophobicContact CG-CG2 4.28Å; L421-V447 WeakPolarHBondContact O-CB 3.11Å; L421-V447 PolarHBondContact O-N 2.91Å
422	M	93.8	Very high	94.3	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.6	-178	-176.8	167.1	-74.3	0	0	109.3	F346 I367 M409 F410 F412 M420 N444 N446	F346-M422 HydrophobicContact CE1-CE 3.73Å; F346-M422 HydrophobicContact CE1-SD 4.47Å; F346-M422 HydrophobicContact CZ-CE 4.14Å; F346-M422 HydrophobicContact CZ-SD 4.48Å; I367-M422 HydrophobicContact CG2-CE 3.62Å; M409-M422 VanDerWaalsContact CA-O 3.31Å; M409-M422 WeakPolarHBondContact CA-O 3.33Å; F410-M422 HydrophobicContact CE1-CG 4.48Å; F410-M422 HydrophobicContact CZ-SD 4.18Å; F410-M422 PolarHBondContact N-O 3.34Å; F410-M422 PolarHBondContact O-N 2.85Å; F412-M422 HydrophobicContact CB-CB 3.98Å; F412-M422 HydrophobicContact CB-CE 3.88Å; F412-M422 HydrophobicContact CB-SD 3.92Å; F412-M422 HydrophobicContact CD1-CE 4.22Å; F412-M422 HydrophobicContact CD2-CE 4.12Å; F412-M422 HydrophobicContact CD2-SD 3.72Å; F412-M422 HydrophobicContact CG-CE 3.81Å; F412-M422 HydrophobicContact CG-SD 3.93Å; M420-M422 PolarHBondContact O-N 2.99Å; M422-N444 HydrophobicContact CE-CB 4.49Å; M422-N444 HydrophobicContact CG-CB 4.41Å; M422-N444 HydrophobicContact SD-CB 3.87Å; M422-N446 WeakPolarHBondContact CE-OD1 3.28Å
423	R	94.9	Very high	94.1	Very high	119 Å²	119	72.3 Å²	72.3	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.1	165.3	-173.3	-167.3	-55.9	-154.8	0.3	107.4	V408 M409 V445 V447	V408-R423 WeakPolarHBondContact O-CA 3.25Å; M409-R423 HydrophobicContact CE-CG 4.39Å; M409-R423 HydrophobicContact CG-CB 4.23Å; M409-R423 HydrophobicContact CG-CG 4.23Å; R423-V445 PolarHBondContact N-O 2.95Å; R423-V445 PolarHBondContact O-N 2.83Å; R423-V447 HydrophobicContact CB-CG2 3.84Å
424	T	96.1	Very high	94	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.9	172.7	-67.6	0	0	0	0	108.9	S407 V408 C442 T443 N444	S407-T424 WeakPolarHBondContact CA-O 3.42Å; V408-T424 PolarHBondContact N-O 3.37Å; V408-T424 PolarHBondContact O-N 2.87Å; T424-C442 HydrophobicContact CG2-CB 3.74Å; T424-T443 WeakPolarHBondContact CA-O 3.38Å; T424-N444 VanDerWaalsContact CG2-OD1 3.23Å; T424-N444 WeakPolarHBondContact CG2-OD1 3.21Å; T424-N444 PolarHBondContact OG1-OD1 3.39Å
425	S	96.8	Very high	93.8	Very high	34 Å²	34	77 Å²	77	24%	0.238	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.8	168.5	-63.5	0	0	0	0	108.2	L406 S407 C442 T443	L406-S425 CarbonylContact O-C 3.51Å; L406-S425 WeakPolarHBondContact O-CA 3.04Å; S407-S425 WeakPolarHBondContact OG-CB 3.27Å; S407-S425 PolarHBondContact OG-OG 3.3Å; S425-C442 CarbonylContact O-C 3.56Å; S425-C442 WeakPolarHBondContact O-CA 3.44Å; S425-T443 PolarHBondContact N-O 2.69Å; S425-T443 PolarHBondContact O-N 3.31Å
426	S	96.8	Very high	93.8	Very high	0 Å²	0	79.4 Å²	79.4	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.6	-172.7	59.1	0	0	0	0	112.5	V398 V405 L406 I441	V398-S426 WeakPolarHBondContact CG2-O 3.46Å; V405-S426 CarbonylContact C-O 3.59Å; V405-S426 WeakPolarHBondContact CA-O 3.41Å; L406-S426 PolarHBondContact N-O 3.47Å; L406-S426 PolarHBondContact O-N 3.24Å; L406-S426 PolarHBondContact O-OG 3.29Å; S426-I441 CarbonylContact C-O 3.57Å; S426-I441 WeakPolarHBondContact CA-O 3.28Å
427	F	97.2	Very high	93.9	Very high	65 Å²	65	77.1 Å²	77.1	29%	0.285	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	156.9	168.7	65.8	-80.9	0	0	0	110.7	V398 V405 I440 I441	V398-F427 VanDerWaalsContact CG2-CA 3.44Å; V405-F427 HydrophobicContact CG2-CB 4.1Å; V405-F427 HydrophobicContact CG2-CD1 4.26Å; V405-F427 HydrophobicContact CG2-CG 4.39Å; F427-I440 CarbonylContact O-C 3.56Å; F427-I440 WeakPolarHBondContact O-CA 3.5Å; F427-I441 HydrophobicContact CD1-CB 4.29Å; F427-I441 HydrophobicContact CE1-CB 3.86Å; F427-I441 HydrophobicContact CE1-CD1 4.46Å; F427-I441 HydrophobicContact CE1-CG2 3.91Å; F427-I441 HydrophobicContact CE2-CB 4.4Å; F427-I441 HydrophobicContact CE2-CD1 3.89Å; F427-I441 HydrophobicContact CE2-CG1 4.46Å; F427-I441 HydrophobicContact CZ-CB 3.93Å; F427-I441 HydrophobicContact CZ-CD1 3.67Å; F427-I441 HydrophobicContact CZ-CG1 4.28Å; F427-I441 HydrophobicContact CZ-CG2 4.13Å; F427-I441 PolarHBondContact N-O 2.83Å; F427-I441 PolarHBondContact O-N 3.23Å
428	T	96.8	Very high	94	Very high	3 Å²	3	71.6 Å²	71.6	2%	0.018	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.2	176.1	27.9	0	0	0	0	111.6	V398 V399 G403 I437 I440	V398-T428 WeakPolarHBondContact O-CG2 3.44Å; V398-T428 PolarHBondContact O-OG1 3.4Å; V399-T428 HydrophobicContact CG2-CG2 4.29Å; G403-T428 WeakPolarHBondContact CA-O 3.44Å; G403-T428 PolarHBondContact N-OG1 3.42Å; T428-I437 HydrophobicContact CG2-CD1 4.03Å; T428-I437 HydrophobicContact CG2-CG1 4.26Å; T428-I437 HydrophobicContact CG2-CG2 3.64Å; T428-I440 HydrophobicContact CG2-CG1 3.8Å
429	F	95.8	Very high	94.2	Very high	67 Å²	67	67.6 Å²	67.6	29%	0.294	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	116.2	167.6	-176.6	-96.7	0	0	0	108.7	I437 E438 Y439 I441	F429-I437 WeakPolarHBondContact O-CA 3.27Å; F429-E438 HydrophobicContact CD1-CB 4.3Å; F429-E438 HydrophobicContact CD1-CG 4.45Å; F429-E438 PolarHBondContact O-N 2.77Å; F429-E438 VanDerWaalsContact O-N 3.15Å; F429-Y439 HydrophobicContact CB-CD2 3.69Å; F429-Y439 HydrophobicContact CB-CE2 3.45Å; F429-Y439 VanDerWaalsContact CB-CE2 3.45Å; F429-Y439 HydrophobicContact CD1-CD2 4.33Å; F429-Y439 HydrophobicContact CD1-CE1 4.21Å; F429-Y439 AromaticContact CD1-CE2 3.53Å; F429-Y439 HydrophobicContact CD1-CE2 3.53Å; F429-Y439 AromaticContact CD1-CZ 3.44Å; F429-Y439 VanDerWaalsContact CD1-CZ 3.44Å; F429-Y439 WeakPolarHBondContact CD1-OH 3.38Å; F429-Y439 HydrophobicContact CD2-CE2 4.39Å; F429-Y439 HydrophobicContact CE1-CE2 4.38Å; F429-Y439 AromaticContact CE1-CZ 3.93Å; F429-Y439 WeakPolarHBondContact CE1-OH 3.26Å; F429-Y439 HydrophobicContact CG-CD2 4.26Å; F429-Y439 AromaticContact CG-CE2 3.53Å; F429-Y439 HydrophobicContact CG-CE2 3.53Å; F429-Y439 AromaticContact CG-CZ 3.94Å; F429-Y439 PolarHBondContact N-O 2.91Å; F429-I441 HydrophobicContact CB-CD1 4.09Å; F429-I441 HydrophobicContact CB-CG1 4.23Å; F429-I441 HydrophobicContact CD2-CD1 4.39Å
430	Q	94	Very high	94.3	Very high	49 Å²	49	62.4 Å²	62.4	23%	0.229	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	138.6	173.6	-76.2	159	98.8	0	0	109.1	K402 P432 E436 I437	K402-Q430 VanDerWaalsContact C-NE2 3.31Å; K402-Q430 PolarHBondContact O-NE2 3.23Å; Q430-P432 WeakPolarHBondContact O-CD 3.39Å; Q430-E436 CarbonylContact C-O 3.09Å; Q430-E436 VanDerWaalsContact CA-O 3.3Å; Q430-E436 WeakPolarHBondContact CA-O 3.48Å; Q430-I437 HydrophobicContact CG-CG1 3.78Å
431	N	91.8	Very high	94.6	Very high	36 Å²	36	61.4 Å²	61.4	19%	0.193	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-64.9	125.3	173.2	-176.9	-69.8	0	0	0	109.5	F433 S434 E435 E436 E438	N431-F433 PolarHBondContact O-N 2.87Å; N431-F433 WeakPolarHBondContact OD1-CA 3.39Å; N431-F433 WeakPolarHBondContact OD1-CB 3.33Å; N431-F433 PolarHBondContact OD1-N 3.18Å; N431-S434 WeakPolarHBondContact CB-OG 3.34Å; N431-S434 PolarHBondContact OD1-N 3.1Å; N431-S434 VanDerWaalsContact OD1-N 3.11Å; N431-E435 WeakPolarHBondContact O-CA 3.29Å; N431-E435 PolarHBondContact O-N 2.9Å; N431-E436 PolarHBondContact N-O 3.27Å; N431-E438 HydrophobicContact CB-CG 4.17Å; N431-E438 PolarHBondContact ND2-OE1 3.01Å
432	P	92.1	Very high	94.8	Very high	106 Å²	106	58.5 Å²	58.5	69%	0.688	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-7.7	-176.3	-25.1	35.7	0	0	0	116.2	Q430	Q430-P432 WeakPolarHBondContact O-CD 3.39Å
433	F	92.3	Very high	94.9	Very high	197 Å²	197	60.4 Å²	60.4	86%	0.864	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	-34.2	-177.9	-57.4	-82.2	0	0	0	113.4	N431	N431-F433 PolarHBondContact O-N 2.87Å; N431-F433 WeakPolarHBondContact OD1-CA 3.39Å; N431-F433 WeakPolarHBondContact OD1-CB 3.33Å; N431-F433 PolarHBondContact OD1-N 3.18Å
434	S	94.1	Very high	94.9	Very high	62 Å²	62	54.9 Å²	54.9	43%	0.434	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-8.1	178.2	68.3	0	0	0	0	114.8	N431 E436	N431-S434 WeakPolarHBondContact CB-OG 3.34Å; N431-S434 PolarHBondContact OD1-N 3.1Å; N431-S434 VanDerWaalsContact OD1-N 3.11Å; S434-E436 PolarHBondContact O-N 2.87Å; S434-E436 PolarHBondContact OG-N 2.64Å
435	E	89.9	Confident	94.7	Very high	140 Å²	140	56.5 Å²	56.5	65%	0.654	29%	0.286	S	S	*	.			trans	58.3	1.5	-170.3	-56.7	-168.3	-175.1	0	0	115.9	N431	N431-E435 WeakPolarHBondContact O-CA 3.29Å; N431-E435 PolarHBondContact O-N 2.9Å
436	E	92.9	Very high	94.3	Very high	142 Å²	142	56.1 Å²	56.1	66%	0.664	28%	0.282	S	S	*	.			trans	-73.2	146.7	179.6	-63.7	-169.6	140.3	0	0	111.9	Q430 N431 S434 E438	Q430-E436 CarbonylContact C-O 3.09Å; Q430-E436 VanDerWaalsContact CA-O 3.3Å; Q430-E436 WeakPolarHBondContact CA-O 3.48Å; N431-E436 PolarHBondContact N-O 3.27Å; S434-E436 PolarHBondContact O-N 2.87Å; S434-E436 PolarHBondContact OG-N 2.64Å; E436-E438 PolarHBondContact O-N 2.69Å
437	I	94.1	Very high	93.8	Very high	47 Å²	47	58.1 Å²	58.1	24%	0.241	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	106.3	176.7	-61.7	161.1	0	0	0	108.8	V399 T428 F429 Q430	V399-I437 HydrophobicContact CG1-CD1 4.01Å; T428-I437 HydrophobicContact CG2-CD1 4.03Å; T428-I437 HydrophobicContact CG2-CG1 4.26Å; T428-I437 HydrophobicContact CG2-CG2 3.64Å; F429-I437 WeakPolarHBondContact O-CA 3.27Å; Q430-I437 HydrophobicContact CG-CG1 3.78Å
438	E	93.4	Very high	92.5	Very high	91 Å²	91	61.5 Å²	61.5	43%	0.425	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-41	175.2	-60.6	-175.3	179.1	0	0	111.5	F429 N431 E436	F429-E438 HydrophobicContact CD1-CB 4.3Å; F429-E438 HydrophobicContact CD1-CG 4.45Å; F429-E438 PolarHBondContact O-N 2.77Å; F429-E438 VanDerWaalsContact O-N 3.15Å; N431-E438 HydrophobicContact CB-CG 4.17Å; N431-E438 PolarHBondContact ND2-OE1 3.01Å; E436-E438 PolarHBondContact O-N 2.69Å
439	Y	96.4	Very high	90.2	Very high	39 Å²	39	67.5 Å²	67.5	15%	0.153	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	158.5	-178.5	40.2	-99.9	0	0	0	112.9	R349 H350 F429 I441	R349-Y439 HydrophobicContact CB-CD2 4.3Å; R349-Y439 HydrophobicContact CB-CG 4.29Å; R349-Y439 HydrophobicContact CG-CD2 4.11Å; R349-Y439 HydrophobicContact CG-CE2 4.49Å; R349-Y439 VanDerWaalsContact NH1-CZ 3.27Å; R349-Y439 PolarHBondContact NH1-OH 2.93Å; H350-Y439 CarbonylContact O-C 3.57Å; H350-Y439 VanDerWaalsContact O-CA 3.23Å; H350-Y439 WeakPolarHBondContact O-CA 3.09Å; H350-Y439 WeakPolarHBondContact O-CB 3.4Å; F429-Y439 HydrophobicContact CB-CD2 3.69Å; F429-Y439 HydrophobicContact CB-CE2 3.45Å; F429-Y439 VanDerWaalsContact CB-CE2 3.45Å; F429-Y439 HydrophobicContact CD1-CD2 4.33Å; F429-Y439 HydrophobicContact CD1-CE1 4.21Å; F429-Y439 AromaticContact CD1-CE2 3.53Å; F429-Y439 HydrophobicContact CD1-CE2 3.53Å; F429-Y439 AromaticContact CD1-CZ 3.44Å; F429-Y439 VanDerWaalsContact CD1-CZ 3.44Å; F429-Y439 WeakPolarHBondContact CD1-OH 3.38Å; F429-Y439 HydrophobicContact CD2-CE2 4.39Å; F429-Y439 HydrophobicContact CE1-CE2 4.38Å; F429-Y439 AromaticContact CE1-CZ 3.93Å; F429-Y439 WeakPolarHBondContact CE1-OH 3.26Å; F429-Y439 HydrophobicContact CG-CD2 4.26Å; F429-Y439 AromaticContact CG-CE2 3.53Å; F429-Y439 HydrophobicContact CG-CE2 3.53Å; F429-Y439 AromaticContact CG-CZ 3.94Å; F429-Y439 PolarHBondContact N-O 2.91Å; Y439-I441 HydrophobicContact CD2-CD1 4.4Å; Y439-I441 HydrophobicContact CD2-CG1 3.75Å; Y439-I441 HydrophobicContact CE2-CD1 3.99Å; Y439-I441 HydrophobicContact CE2-CG1 3.86Å
440	I	97.1	Very high	87.3	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.5	164.3	-59.3	164.8	0	0	0	107.5	R349 H350 F395 V398 V399 F427 T428	R349-I440 CarbonylContact C-O 3.45Å; R349-I440 VanDerWaalsContact CA-O 3.3Å; R349-I440 WeakPolarHBondContact CA-O 3.44Å; H350-I440 HydrophobicContact CB-CB 4.45Å; H350-I440 PolarHBondContact N-O 2.85Å; H350-I440 PolarHBondContact O-N 2.68Å; F395-I440 HydrophobicContact CD1-CD1 3.48Å; F395-I440 VanDerWaalsContact CD1-CD1 3.48Å; F395-I440 HydrophobicContact CE1-CD1 3.85Å; F395-I440 HydrophobicContact CE1-CG2 4.37Å; F395-I440 HydrophobicContact CG-CD1 4.4Å; V398-I440 HydrophobicContact CG1-CD1 3.91Å; V398-I440 HydrophobicContact CG1-CG1 4.18Å; V398-I440 HydrophobicContact CG1-CG2 3.92Å; V399-I440 HydrophobicContact CG2-CD1 4.02Å; F427-I440 CarbonylContact O-C 3.56Å; F427-I440 WeakPolarHBondContact O-CA 3.5Å; T428-I440 HydrophobicContact CG2-CG1 3.8Å
441	I	97.5	Very high	84.5	Confident	32 Å²	32	72.6 Å²	72.6	16%	0.164	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	132.8	170.8	-56.9	-177.9	0	0	0	108	I347 R349 S426 F427 F429 Y439	I347-I441 HydrophobicContact CG2-CG2 4.35Å; R349-I441 HydrophobicContact CG-CG1 4.35Å; S426-I441 CarbonylContact C-O 3.57Å; S426-I441 WeakPolarHBondContact CA-O 3.28Å; F427-I441 HydrophobicContact CD1-CB 4.29Å; F427-I441 HydrophobicContact CE1-CB 3.86Å; F427-I441 HydrophobicContact CE1-CD1 4.46Å; F427-I441 HydrophobicContact CE1-CG2 3.91Å; F427-I441 HydrophobicContact CE2-CB 4.4Å; F427-I441 HydrophobicContact CE2-CD1 3.89Å; F427-I441 HydrophobicContact CE2-CG1 4.46Å; F427-I441 HydrophobicContact CZ-CB 3.93Å; F427-I441 HydrophobicContact CZ-CD1 3.67Å; F427-I441 HydrophobicContact CZ-CG1 4.28Å; F427-I441 HydrophobicContact CZ-CG2 4.13Å; F427-I441 PolarHBondContact N-O 2.83Å; F427-I441 PolarHBondContact O-N 3.23Å; F429-I441 HydrophobicContact CB-CD1 4.09Å; F429-I441 HydrophobicContact CB-CG1 4.23Å; F429-I441 HydrophobicContact CD2-CD1 4.39Å; Y439-I441 HydrophobicContact CD2-CD1 4.4Å; Y439-I441 HydrophobicContact CD2-CG1 3.75Å; Y439-I441 HydrophobicContact CE2-CD1 3.99Å; Y439-I441 HydrophobicContact CE2-CG1 3.86Å
442	C	97.1	Very high	81.5	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	116.3	179.8	-71.4	0	0	0	0	110.7	I347 S348 H350 T424 S425 N444	I347-C442 WeakPolarHBondContact CA-O 3.07Å; S348-C442 PolarHBondContact N-O 2.93Å; S348-C442 PolarHBondContact O-N 3.49Å; H350-C442 PolarHBondContact CD2-SG 3Å; T424-C442 HydrophobicContact CG2-CB 3.74Å; S425-C442 CarbonylContact O-C 3.56Å; S425-C442 WeakPolarHBondContact O-CA 3.44Å; C442-N444 PolarHBondContact O-ND2 2.8Å
443	T	95.6	Very high	78.5	Confident	40 Å²	40	81.5 Å²	81.5	25%	0.245	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.8	165.7	-58.8	0	0	0	0	108.5	E345 T424 S425 V445	E345-T443 WeakPolarHBondContact OE2-CG2 3.33Å; T424-T443 WeakPolarHBondContact CA-O 3.38Å; S425-T443 PolarHBondContact N-O 2.69Å; S425-T443 PolarHBondContact O-N 3.31Å; T443-V445 HydrophobicContact CG2-CG2 4.27Å
444	N	94.8	Very high	75.7	Confident	2 Å²	2	77.7 Å²	77.7	1%	0.011	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.3	-169.1	-48.7	-79.5	0	0	0	108.9	E345 F346 S348 M422 T424 C442	E345-N444 CarbonylContact C-O 3.58Å; E345-N444 WeakPolarHBondContact CA-O 3.49Å; E345-N444 WeakPolarHBondContact CB-O 3.39Å; F346-N444 HydrophobicContact CD1-CB 4Å; F346-N444 HydrophobicContact CD2-CB 4.48Å; F346-N444 HydrophobicContact CE1-CB 3.6Å; F346-N444 HydrophobicContact CE2-CB 4.11Å; F346-N444 HydrophobicContact CG-CB 4.43Å; F346-N444 HydrophobicContact CZ-CB 3.65Å; F346-N444 PolarHBondContact N-O 2.72Å; F346-N444 WeakPolarHBondContact O-CB 3.21Å; F346-N444 PolarHBondContact O-N 2.78Å; F346-N444 PolarHBondContact O-ND2 3.13Å; S348-N444 PolarHBondContact OG-ND2 2.67Å; M422-N444 HydrophobicContact CE-CB 4.49Å; M422-N444 HydrophobicContact CG-CB 4.41Å; M422-N444 HydrophobicContact SD-CB 3.87Å; T424-N444 VanDerWaalsContact CG2-OD1 3.23Å; T424-N444 WeakPolarHBondContact CG2-OD1 3.21Å; T424-N444 PolarHBondContact OG1-OD1 3.39Å; C442-N444 PolarHBondContact O-ND2 2.8Å
445	V	92.5	Very high	72.7	Confident	34 Å²	34	82.8 Å²	82.8	21%	0.206	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.8	-171.9	-169.9	0	0	0	0	110.3	P343 E345 R423 T443 V447	P343-V445 HydrophobicContact CB-CG1 3.67Å; E345-V445 HydrophobicContact CB-CG2 4.04Å; R423-V445 PolarHBondContact N-O 2.95Å; R423-V445 PolarHBondContact O-N 2.83Å; T443-V445 HydrophobicContact CG2-CG2 4.27Å; V445-V447 PolarHBondContact O-N 3.01Å
446	N	88.5	Confident	69.9	Low	27 Å²	27	81.4 Å²	81.4	14%	0.144	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	117.8	173.8	-73	-0.3	0	0	0	110.7	S366 M422 K448	S366-N446 PolarHBondContact O-ND2 2.77Å; S366-N446 PolarHBondContact OG-ND2 3.45Å; S366-N446 PolarHBondContact OG-OD1 3.3Å; M422-N446 WeakPolarHBondContact CE-OD1 3.28Å; N446-K448 PolarHBondContact O-N 3.45Å
447	V	85.9	Confident	67	Low	42 Å²	42	80.7 Å²	80.7	26%	0.255	45%	0.446	S	S	.	.			trans	-82.1	97.5	175.7	-175.3	0	0	0	0	108.5	L421 R423 V445 N449	L421-V447 HydrophobicContact CB-CB 4.2Å; L421-V447 HydrophobicContact CD2-CB 4.04Å; L421-V447 HydrophobicContact CD2-CG1 3.94Å; L421-V447 HydrophobicContact CG-CB 3.97Å; L421-V447 HydrophobicContact CG-CG1 4.43Å; L421-V447 HydrophobicContact CG-CG2 4.28Å; L421-V447 WeakPolarHBondContact O-CB 3.11Å; L421-V447 PolarHBondContact O-N 2.91Å; R423-V447 HydrophobicContact CB-CG2 3.84Å; V445-V447 PolarHBondContact O-N 3.01Å; V447-N449 PolarHBondContact O-N 2.99Å
448	K	70.9	Confident	64	Low	135 Å²	135	85.8 Å²	85.8	59%	0.587	47%	0.472	S	S	*	.			trans	-69.1	115.5	170.3	-65.5	179.2	-176	173	0	109	S341 N446 S450	S341-K448 PolarHBondContact OG-NZ 2.67Å; N446-K448 PolarHBondContact O-N 3.45Å; K448-S450 PolarHBondContact O-N 3.5Å
449	N	47.2	Very low	60.9	Low	129 Å²	129	86.6 Å²	86.6	69%	0.69	49%	0.488	S	S	*	.			trans	-67.1	99.1	167	-75.8	2.1	0	0	0	108.9	V447	V447-N449 PolarHBondContact O-N 2.99Å
450	S	34.9	Very low	57.7	Low	104 Å²	104	90.4 Å²	90.4	73%	0.727	52%	0.52	S	S	*	.			trans	-69.4	135.5	165.9	-158.2	0	0	0	0	109	K448	K448-S450 PolarHBondContact O-N 3.5Å
451	T	34.9	Very low	54.9	Low	120 Å²	120	96.7 Å²	96.7	74%	0.736	56%	0.561	S	S	*	*			trans	54.4	89.8	178.9	52.9	0	0	0	0	117
452	Q	30.4	Very low	51.6	Low	182 Å²	182	98.6 Å²	98.6	85%	0.85	59%	0.589	S	S	*	*				-134.5	113.1	129.9	-78.8	-165.6	-1.4	0	0	108.6
453	D	27.2	Very low	48.4	Very low	146 Å²	146	103.4 Å²	103.4	78%	0.781	63%	0.628	S	S	*	*			trans	-76.9	125.7	171	-72.3	-64.2	0	0	0	110.1	L455	D453-L455 PolarHBondContact O-N 3.08Å
454	P	34.3	Very low	45.8	Very low	117 Å²	117	107.6 Å²	107.6	76%	0.76	66%	0.656	S	S	*	*			trans	-79.5	89.9	-179	31.4	-34.2	0	0	0	111.3	T456	P454-T456 PolarHBondContact O-N 3.05Å
455	L	31.3	Very low	42.7	Very low	169 Å²	169	115.2 Å²	115.2	89%	0.885	69%	0.694	S	S	*	*			trans	-65.4	118.3	169.5	-78.2	173	0	0	0	110.9	D453	D453-L455 PolarHBondContact O-N 3.08Å
456	T	30.3	Very low	40.4	Very low	111 Å²	111	119.5 Å²	119.5	68%	0.681	72%	0.722	S	S	*	*			trans	-78.2	134.1	-179.6	49	0	0	0	0	112	P454 I458	P454-T456 PolarHBondContact O-N 3.05Å; T456-I458 PolarHBondContact O-N 2.88Å
457	P	31.9	Very low	37.4	Very low	127 Å²	127	126 Å²	126	83%	0.825	76%	0.756	S	S	*	*			trans	-79	112.5	172	30.6	-32	0	0	0	110.4
458	I	31.2	Very low	34.6	Very low	155 Å²	155	127 Å²	127	80%	0.795	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-95.3	130.8	171.8	-69.6	179.2	0	0	0	109.9	T456	T456-I458 PolarHBondContact O-N 2.88Å
459	S	29.3	Very low	32.7	Very low	108 Å²	108	130 Å²	130	76%	0.755	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-88.6	144.9	177.5	-51.9	0	0	0	0	112.6
460	S	28.6	Very low	31.7	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-67.8	147.8	172.6	-45	0	0	0	0	112.5
461	P	39	Very low	31.4	Very low	132 Å²	132	129.9 Å²	129.9	86%	0.857	80%	0.8	S	S	*	*				-131.6	-178.8	106	37.2	-28.4	0	0	0	111.7
462	G	28.5	Very low	32.1	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	80%	0.799	S	S	*	*			trans	-163.2	-172.5	-173.3	0	0	0	0	0	119.1
463	A	28.9	Very low	32	Very low	100 Å²	100	128.5 Å²	128.5	83%	0.826	80%	0.8	S	S	*	*			trans	70	155.6	-179.5	0	0	0	0	0	117
464	P	41.3	Very low	32	Very low	128 Å²	128	124.9 Å²	124.9	83%	0.831	80%	0.798	S	S	*	*			cis	-124.3	-173.8	-4.3	38.1	-20.5	0	0	0	115.6
465	M	29.6	Very low	31.7	Very low	163 Å²	163	128.5 Å²	128.5	80%	0.803	80%	0.804	S	S	*	*			trans	-81	161.6	-176.2	-62.3	-86.6	-72.8	0	0	114.1
466	P	43.5	Very low	32.5	Very low	124 Å²	124	126.3 Å²	126.3	81%	0.805	80%	0.8	S	S	*	*				-144.6	177.2	84.5	34.6	-16	0	0	0	114.3
467	L	26.7	Very low	32.4	Very low	163 Å²	163	124.8 Å²	124.8	85%	0.853	80%	0.798	S	S	*	*			cis	-175.8	134.5	-29.5	175	74.1	0	0	0	107.8
468	G	26.7	Very low	32.1	Very low	62 Å²	62	124.8 Å²	124.8	64%	0.639	80%	0.796	S	S	*	*			trans	150	108.1	157.7	0	0	0	0	0	119.7
469	Q	29.9	Very low	32	Very low	199 Å²	199	125.1 Å²	125.1	93%	0.93	80%	0.798	S	S	*	*			trans	56.8	138.5	145.6	-55.4	-177.7	23.3	0	0	119.8
470	S	27.3	Very low	31.8	Very low	114 Å²	114	125.1 Å²	125.1	80%	0.797	80%	0.798	S	S	*	*			cis	-157.3	151.4	-2.7	49.7	0	0	0	0	112.2
471	S	28.3	Very low	32.4	Very low	116 Å²	116	125.1 Å²	125.1	81%	0.811	80%	0.795	S	S	*	*			trans	-78.1	-179.6	172.2	-112.1	0	0	0	0	112.6
472	P	49.4	Very low	31.8	Very low	110 Å²	110	122.6 Å²	122.6	71%	0.714	79%	0.794	S	S	*	*			cis	-127.8	-166.5	14.7	43.8	-25.4	0	0	0	113.2
473	N	29.4	Very low	32.6	Very low	163 Å²	163	124.2 Å²	124.2	87%	0.872	79%	0.791	S	S	*	*			cis	-160.4	161.6	13.9	-149.9	0.3	0	0	0	112.1
474	G	27.2	Very low	32.5	Very low	71 Å²	71	127.9 Å²	127.9	73%	0.732	79%	0.793	S	S	*	*			trans	106.3	94.4	157.5	0	0	0	0	0	119.8
475	H	26.6	Very low	31.9	Very low	193 Å²	193	126.1 Å²	126.1	89%	0.894	79%	0.789	S	S	*	*			trans	-113.6	-179	164.3	-84.5	-70.2	0	0	0	109.8
476	P	49.1	Very low	32	Very low	122 Å²	122	123.1 Å²	123.1	79%	0.792	79%	0.791	S	S	*	*			cis	-114.1	-137.3	-8.9	27.9	-3.3	0	0	0	109.9
477	A	28.3	Very low	31.3	Very low	79 Å²	79	128.2 Å²	128.2	65%	0.653	79%	0.794	S	S	*	*			cis	-154.8	148.6	-0.5	0	0	0	0	0	109.9
478	V	26	Very low	31.5	Very low	128 Å²	128	127.7 Å²	127.7	78%	0.776	79%	0.787	S	S	*	*				65.6	111.7	76.8	-168.9	0	0	0	0	113.4
479	L	28.4	Very low	31.9	Very low	162 Å²	162	132.5 Å²	132.5	85%	0.848	80%	0.797	S	S	*	*				-154.9	162.9	82.7	-88.3	167.3	0	0	0	115.3
480	S	24.3	Very low	31.9	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	79%	0.794	S	S	*	*			trans	-128.9	-165	162.4	-44.8	0	0	0	0	107.5
481	P	42.7	Very low	32.1	Very low	118 Å²	118	135 Å²	135	77%	0.766	80%	0.796	S	S	*	*			cis	-140.2	146.2	-11.9	37.4	-17.9	0	0	0	117.2
482	G	26.7	Very low	32.2	Very low	80 Å²	80	137.1 Å²	137.1	83%	0.825	79%	0.793	S	S	*	*			trans	53.1	-158.8	154.3	0	0	0	0	0	119
483	P	43.4	Very low	31.4	Very low	107 Å²	107	139.9 Å²	139.9	70%	0.695	80%	0.797	S	S	*	*			cis	-135.4	-171.7	-24.3	37.7	-19.1	0	0	0	113.7
484	M	28.1	Very low	31.4	Very low	177 Å²	177	140.6 Å²	140.6	87%	0.872	80%	0.795	S	S	*	*			trans	70.4	168	166.5	-56.9	-179.2	-69.5	0	0	118.4
485	A	28.4	Very low	31.4	Very low	90 Å²	90	146.6 Å²	146.6	74%	0.744	80%	0.804	S	S	*	*				-175.6	137.3	-52.6	0	0	0	0	0	110.6
486	A	31.4	Very low	31.5	Very low	101 Å²	101	141 Å²	141	84%	0.835	79%	0.791	S	S	*	*			trans	40.3	87.9	154.7	0	0	0	0	0	120.9
487	R	29.8	Very low	30.3	Very low	231 Å²	231	142.9 Å²	142.9	87%	0.872	79%	0.794	S	S	*	*			trans	-170.7	153.9	148	-110.5	-179.7	179.2	-172.7	-2.3	108.1
488	Q	30.4	Very low	30.4	Very low	151 Å²	151	146.7 Å²	146.7	71%	0.706	80%	0.803	S	S	*	*			cis	-155.5	148.1	-1.5	-173.1	163.4	-37.7	0	0	108.3
489	L	34.4	Very low	30.3	Very low	164 Å²	164	149.3 Å²	149.3	86%	0.859	81%	0.806	S	S	*	*			trans	-75.3	154.5	166.9	-121	92	0	0	0	110.5
490	Q	30.4	Very low	30.2	Very low	184 Å²	184	145.2 Å²	145.2	86%	0.86	80%	0.803	S	S	*	*			trans	80.9	87.5	160.9	-164	168.2	28.9	0	0	118.9
491	Q	31.3	Very low	30.2	Very low	180 Å²	180	144 Å²	144	84%	0.841	81%	0.807	S	S	*	*			trans	-172.1	152.6	132.6	-96.5	-175	4	0	0	107.2
492	Q	30.4	Very low	29.6	Very low	161 Å²	161	142.8 Å²	142.8	75%	0.752	81%	0.808	S	S	*	*			cis	-160.5	154	-25	174.5	159.6	1.2	0	0	107.6
493	Q	32.3	Very low	29.7	Very low	169 Å²	169	145.5 Å²	145.5	79%	0.79	81%	0.808	S	S	*	*			trans	-87.3	148.1	173.1	-172.3	169.6	14.4	0	0	111.1
494	Q	29.8	Very low	29.2	Very low	177 Å²	177	149.7 Å²	149.7	83%	0.827	81%	0.81	S	S	*	*			trans	69.9	139.2	-171	-68.2	157	3.1	0	0	112.4
495	Q	26.9	Very low	29	Very low	198 Å²	198	147 Å²	147	93%	0.925	80%	0.8	S	S	*	*			cis	-134.8	171.5	37.9	-161.3	156.1	-9	0	0	114.2
496	A	28.3	Very low	29.3	Very low	76 Å²	76	145.9 Å²	145.9	63%	0.628	80%	0.797	S	S	*	*			trans	-101.4	-174.2	179.6	0	0	0	0	0	112.4
497	D	25.3	Very low	29.4	Very low	161 Å²	161	149.3 Å²	149.3	86%	0.861	80%	0.798	S	S	*	*			trans	72.1	104.3	166.5	-59.6	-54.4	0	0	0	118.7
498	L	29.1	Very low	29.6	Very low	158 Å²	158	147.8 Å²	147.8	83%	0.827	79%	0.793	S	S	*	*			trans	-129	143.8	136.5	-109.9	162.6	0	0	0	108.1
499	E	24.4	Very low	29.3	Very low	183 Å²	183	148.8 Å²	148.8	86%	0.855	80%	0.798	S	S	*	*			trans	-46.6	160.1	-171.1	-57.8	153	117.2	0	0	115.9
500	G	25.6	Very low	29.1	Very low	76 Å²	76	145.5 Å²	145.5	78%	0.784	79%	0.794	S	S	*	*			cis	144.5	143.5	2.5	0	0	0	0	0	111.7
501	G	25.3	Very low	29	Very low	81 Å²	81	140.1 Å²	140.1	84%	0.835	79%	0.788	S	S	*	*			trans	88.1	114.8	-179.6	0	0	0	0	0	114.2
502	A	29.8	Very low	29.6	Very low	94 Å²	94	136.9 Å²	136.9	78%	0.777	78%	0.783	S	S	*	*			cis	92.5	97.1	7.7	0	0	0	0	0	118.6
503	T	28.5	Very low	29.6	Very low	136 Å²	136	136.8 Å²	136.8	83%	0.834	79%	0.786	S	S	*	*			trans	-141.2	133.7	138.5	40.9	0	0	0	0	106.9
504	R	32.7	Very low	29.2	Very low	195 Å²	195	133 Å²	133	74%	0.736	78%	0.778	S	S	*	*			cis	79.2	136.8	41.2	-64.3	-165.3	76.4	148.5	10.3	112.7
505	D	25.7	Very low	29.1	Very low	121 Å²	121	131.3 Å²	131.3	65%	0.647	77%	0.773	S	S	*	*			cis	-144.4	172.3	11.9	-104.5	-45.1	0	0	0	113.3
506	G	34.6	Very low	29	Very low	66 Å²	66	129.1 Å²	129.1	68%	0.68	76%	0.763	S	S	*	*			trans	-147.9	134.7	157.3	0	0	0	0	0	110.3
507	M	32.9	Very low	29.1	Very low	174 Å²	174	132.6 Å²	132.6	86%	0.857	77%	0.766	S	S	*	*			trans	-166.3	169.5	178.9	-111.2	174.6	175.3	0	0	108.2
508	Y	33.8	Very low	29.4	Very low	199 Å²	199	131.8 Å²	131.8	78%	0.78	76%	0.757	S	S	*	*			cis	-145.8	172.9	24.9	56.2	-69	0	0	0	109.3
509	E	24.3	Very low	29	Very low	172 Å²	172	132.4 Å²	132.4	80%	0.804	76%	0.758	S	S	*	*			cis	-145.8	179.1	16	-145.8	169.4	170	0	0	112.8
510	A	30.3	Very low	30	Very low	94 Å²	94	128.6 Å²	128.6	78%	0.777	75%	0.749	S	S	*	*			trans	-150.5	166.6	-179	0	0	0	0	0	112.9
511	G	27.1	Very low	30.1	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	75%	0.753	S	S	*	*			trans	-140	146.8	172.5	0	0	0	0	0	112.7
512	P	43.9	Very low	30.1	Very low	113 Å²	113	136.2 Å²	136.2	73%	0.734	75%	0.752	S	S	*	*			trans	-142.9	-172	-132.1	40.5	-20	0	0	0	118
513	I	29.8	Very low	30.8	Very low	158 Å²	158	136.5 Å²	136.5	81%	0.81	75%	0.746	S	S	*	*			trans	79.8	137.6	163	-59.1	163.8	0	0	0	114.6
514	S	25.8	Very low	30.6	Very low	89 Å²	89	137 Å²	137	62%	0.622	75%	0.748	S	S	*	*			cis	-148	148.2	12	-119.1	0	0	0	0	110.5
515	I	27.1	Very low	30.3	Very low	143 Å²	143	132.1 Å²	132.1	73%	0.733	75%	0.75	S	S	*	*				62.2	127.8	83.9	-60.7	177	0	0	0	112.8
516	Q	25.5	Very low	30.4	Very low	152 Å²	152	130.6 Å²	130.6	71%	0.71	75%	0.754	S	S	*	*			cis	-163.7	156	31.9	-143.5	157.7	-17.3	0	0	115.3
517	Q	30.2	Very low	30	Very low	149 Å²	149	134.5 Å²	134.5	70%	0.696	76%	0.764	S	S	*	*			trans	36.9	160.2	142.4	-71.7	174.8	-41	0	0	124.8
518	Q	30	Very low	29.6	Very low	144 Å²	144	129.1 Å²	129.1	67%	0.673	75%	0.754	S	S	*	*			cis	178.5	117.4	-22.5	172.2	170.1	4.9	0	0	113.7
519	M	22	Very low	30.3	Very low	171 Å²	171	125.6 Å²	125.6	84%	0.842	76%	0.755	S	S	*	*			trans	56.7	171.9	150	-74.9	-70	-168.3	0	0	121.4
520	P	44.8	Very low	30.5	Very low	103 Å²	103	124 Å²	124	67%	0.669	75%	0.752	S	S	*	*			cis	-138.5	-171.4	-26.3	29.3	-5	0	0	0	116.3
521	V	27.8	Very low	30.6	Very low	141 Å²	141	127.8 Å²	127.8	86%	0.855	75%	0.753	S	S	*	*			trans	87.3	149.5	154.4	-145.4	0	0	0	0	121.8
522	Q	25.2	Very low	30.7	Very low	176 Å²	176	127.8 Å²	127.8	82%	0.822	75%	0.754	S	S	*	*			trans	-92.1	-171.8	178.5	-102.1	-175.6	26	0	0	113.1
523	P	44.5	Very low	30.4	Very low	100 Å²	100	131.8 Å²	131.8	65%	0.649	76%	0.759	S	S	*	*			cis	-142.2	-167.5	-28.9	38.1	-17.4	0	0	0	115.3
524	V	24.4	Very low	30.3	Very low	145 Å²	145	129.6 Å²	129.6	88%	0.879	75%	0.753	S	S	*	*			trans	76.9	148.4	159	179.5	0	0	0	0	118.5
525	A	27.4	Very low	30.7	Very low	93 Å²	93	132.3 Å²	132.3	77%	0.769	76%	0.76	S	S	*	*			trans	-103.9	165.1	-164.1	0	0	0	0	0	115.4
526	A	26.6	Very low	30.8	Very low	89 Å²	89	132 Å²	132	74%	0.736	76%	0.755	S	S	*	*				162.7	158	120.9	0	0	0	0	0	114.6
527	V	25.6	Very low	31.1	Very low	148 Å²	148	131.6 Å²	131.6	90%	0.897	75%	0.751	S	S	*	*			trans	69.5	142.2	162.8	-147.1	0	0	0	0	118.7
528	G	25.4	Very low	31.3	Very low	62 Å²	62	130.9 Å²	130.9	64%	0.639	75%	0.747	S	S	*	*			trans	-112	-139.3	166	0	0	0	0	0	111.2
529	P	48.3	Very low	31.3	Very low	124 Å²	124	130 Å²	130	81%	0.805	74%	0.743	S	S	*	*			cis	-139.6	-178.7	-13.4	41.1	-22.8	0	0	0	115.7
530	D	28.3	Very low	31.7	Very low	139 Å²	139	129 Å²	129	74%	0.743	74%	0.74	S	S	*	*			trans	86.2	155.9	142.2	-133.2	-32.6	0	0	0	123.6
531	H	32.5	Very low	31	Very low	173 Å²	173	133.1 Å²	133.1	80%	0.801	74%	0.743	S	S	*	*			trans	93.8	122	157.3	-69	7.5	0	0	0	123.2
532	G	30.1	Very low	32.8	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	74%	0.736	S	S	*	*			trans	118.6	79.3	156	0	0	0	0	0	116.3
533	K	37.3	Very low	33.9	Very low	196 Å²	196	128.2 Å²	128.2	85%	0.852	73%	0.73	S	S	*	*				66.6	151.9	71.8	-77.3	-167.4	177.6	-178.8	0	117.1
534	T	27.3	Very low	33.3	Very low	112 Å²	112	130.6 Å²	130.6	69%	0.687	74%	0.736	S	S	*	*			cis	-106.3	-130.3	-1.3	-34.3	0	0	0	0	110.1	E536	T534-E536 HydrophobicContact CG2-CG 4.36Å
535	I	33.9	Very low	33.6	Very low	147 Å²	147	133 Å²	133	75%	0.754	73%	0.734	S	S	*	*			cis	-159.1	145.5	-7.6	-144	165.4	0	0	0	104.6
536	E	29.5	Very low	34.5	Very low	135 Å²	135	134 Å²	134	63%	0.631	73%	0.734	S	S	*	*			cis	-159.9	-179.6	-25.6	-108	-165.2	137.6	0	0	105.1	T534	T534-E536 HydrophobicContact CG2-CG 4.36Å
537	K	32.4	Very low	34.5	Very low	144 Å²	144	133.1 Å²	133.1	63%	0.626	73%	0.733	S	S	*	*			cis	-164	-169.7	6.9	-117.5	175.4	169.5	68	0	103.4
538	Q	33.3	Very low	35.5	Very low	134 Å²	134	132.1 Å²	132.1	63%	0.626	73%	0.729	S	S	*	*			cis	171.6	136	-29.6	172.8	170.9	32.3	0	0	105.9
539	E	31.3	Very low	35.6	Very low	125 Å²	125	135.5 Å²	135.5	58%	0.584	73%	0.733	S	S	*	*			cis	-154.2	-160.7	-6.5	-122.8	-178.7	110.6	0	0	107.6	Y541	E539-Y541 WeakPolarHBondContact OE1-CE2 3.4Å
540	I	29.7	Very low	34.7	Very low	151 Å²	151	136.4 Å²	136.4	77%	0.774	73%	0.726	S	S	*	*			cis	-147.2	-146.9	20	-153	154.9	0	0	0	112.8
541	Y	30.4	Very low	34.7	Very low	189 Å²	189	135 Å²	135	74%	0.741	72%	0.723	S	S	*	*			trans	-105.2	167.9	-157.8	-90.5	-107.6	0	0	0	117.4	E539	E539-Y541 WeakPolarHBondContact OE1-CE2 3.4Å
542	P	64.8	Low	34.5	Very low	108 Å²	108	136.7 Å²	136.7	70%	0.701	73%	0.728	S	S	*	*			trans	-101.9	-164.8	177.7	41.4	-32.4	0	0	0	113
543	P	50	Low	34.2	Very low	106 Å²	106	137.1 Å²	137.1	69%	0.688	73%	0.733	S	S	*	*				-163.1	164.6	94.7	43.7	-23.1	0	0	0	120.8
544	I	31.5	Very low	33.7	Very low	151 Å²	151	136.6 Å²	136.6	77%	0.774	74%	0.735	S	S	*	*			trans	58.5	125.3	133.6	-66.8	170.3	0	0	0	123.9
545	F	29.7	Very low	34.9	Very low	194 Å²	194	136 Å²	136	85%	0.851	73%	0.733	S	S	*	*			trans	30	172	142	-82	-78.8	0	0	0	123.7
546	P	47.3	Very low	34.6	Very low	116 Å²	116	134.5 Å²	134.5	75%	0.753	73%	0.731	S	S	*	*			cis	-134.9	172.9	-18.4	37.2	-20.1	0	0	0	115.9
547	G	25.1	Very low	34.5	Very low	70 Å²	70	135.2 Å²	135.2	72%	0.722	74%	0.739	S	S	*	*			trans	106	170.1	144.6	0	0	0	0	0	119.1
548	P	47.3	Very low	34.3	Very low	126 Å²	126	132.4 Å²	132.4	82%	0.818	74%	0.738	S	S	*	*				-134.2	175.6	-123.4	42.9	-28.8	0	0	0	118
549	D	27.5	Very low	34	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	75%	0.746	S	S	*	*			trans	92.5	139.2	140.2	-129.1	-5.5	0	0	0	124.1
550	Q	29	Very low	34.7	Very low	144 Å²	144	131.3 Å²	131.3	67%	0.673	75%	0.751	S	S	*	*			trans	23.2	117.2	153.5	-84.1	170.8	98.1	0	0	126.7
551	T	28.8	Very low	34.7	Very low	108 Å²	108	129.3 Å²	129.3	66%	0.663	75%	0.75	S	S	*	*				65.5	143.9	121.2	67.2	0	0	0	0	125.5
552	K	28	Very low	34.6	Very low	209 Å²	209	126.8 Å²	126.8	91%	0.909	76%	0.755	S	S	*	*			trans	64.9	134.8	146.6	-75.4	170.5	177.5	175.3	0	119.9
553	G	25	Very low	32.9	Very low	82 Å²	82	129.1 Å²	129.1	85%	0.845	76%	0.756	S	S	*	*			trans	161.8	91.9	157.7	0	0	0	0	0	118.2
554	M	27	Very low	31.9	Very low	184 Å²	184	130 Å²	130	91%	0.906	75%	0.754	S	S	*	*			trans	-87.1	177	156.6	-81.2	-86.4	-170.3	0	0	109.4
555	P	51	Low	31.7	Very low	100 Å²	100	132.6 Å²	132.6	65%	0.649	76%	0.756	S	S	*	*			cis	-142.5	178.4	-16.4	29.9	-6	0	0	0	117.2
556	T	27.2	Very low	31.6	Very low	115 Å²	115	128.8 Å²	128.8	71%	0.706	75%	0.748	S	S	*	*			trans	64.7	147.6	140.7	48.4	0	0	0	0	125.9
557	N	27.6	Very low	30.7	Very low	150 Å²	150	129.5 Å²	129.5	80%	0.802	75%	0.746	S	S	*	*			trans	76	148.3	151.1	-75.3	-1.2	0	0	0	120.1
558	S	27.9	Very low	30.7	Very low	85 Å²	85	133 Å²	133	59%	0.594	75%	0.748	S	S	*	*			cis	-175.2	136.7	-13.8	50.5	0	0	0	0	114.5
559	T	27	Very low	29.8	Very low	130 Å²	130	136.5 Å²	136.5	80%	0.798	75%	0.751	S	S	*	*			trans	58.3	166.1	144.7	48.6	0	0	0	0	122.4
560	P	46.6	Very low	29.8	Very low	107 Å²	107	135.3 Å²	135.3	70%	0.695	75%	0.753	S	S	*	*			cis	-141	-179.6	-30.2	37.6	-18.7	0	0	0	116.8
561	S	29.7	Very low	29.6	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	76%	0.761	S	S	*	*			trans	78.6	118.3	147.3	-64.1	0	0	0	0	122.6
562	T	28.4	Very low	29.5	Very low	136 Å²	136	131.8 Å²	131.8	83%	0.834	77%	0.766	S	S	*	*			trans	151.8	135.1	132.6	-68.3	0	0	0	0	111.6
563	Q	29.1	Very low	29.5	Very low	157 Å²	157	133.6 Å²	133.6	73%	0.734	77%	0.768	S	S	*	*			cis	-164.8	167.7	-24.8	-111.6	-57.6	9.7	0	0	110.6
564	I	28.5	Very low	29.6	Very low	125 Å²	125	134.4 Å²	134.4	64%	0.641	76%	0.76	S	S	*	*			trans	62.4	102.9	152.4	-67.5	170.3	0	0	0	120.3
565	Y	28.5	Very low	29.6	Very low	206 Å²	206	131.2 Å²	131.2	81%	0.808	75%	0.747	S	S	*	*			trans	55	137.5	133.2	-76	-84	0	0	0	121.8
566	T	26.3	Very low	28.4	Very low	113 Å²	113	133.1 Å²	133.1	69%	0.693	75%	0.752	S	S	*	*			cis	-148.7	153	13.5	-48.2	0	0	0	0	113.1
567	N	28.5	Very low	28.4	Very low	132 Å²	132	133.3 Å²	133.3	71%	0.706	76%	0.758	S	S	*	*			trans	-18.3	152	160.3	-59	6.8	0	0	0	118.5
568	N	27	Very low	28.3	Very low	144 Å²	144	137 Å²	137	77%	0.77	76%	0.762	S	S	*	*			cis	-151.2	141.2	18.3	-123.7	5.9	0	0	0	112.8
569	F	27.2	Very low	28.3	Very low	198 Å²	198	138.5 Å²	138.5	87%	0.868	77%	0.773	S	S	*	*			trans	-113	177.9	159.5	-95.6	-100.2	0	0	0	107.4
570	S	27.8	Very low	28.2	Very low	108 Å²	108	139.9 Å²	139.9	76%	0.755	78%	0.775	S	S	*	*			cis	-148.9	156.9	15.7	-34.9	0	0	0	0	111.9
571	A	25.2	Very low	27.3	Very low	102 Å²	102	139.8 Å²	139.8	84%	0.843	78%	0.777	S	S	*	*			trans	-86.7	167	147.9	0	0	0	0	0	110
572	G	26.7	Very low	27.2	Very low	76 Å²	76	140.9 Å²	140.9	78%	0.784	78%	0.784	S	S	*	*			trans	-139.8	136.5	178.6	0	0	0	0	0	114
573	R	26.3	Very low	27.2	Very low	247 Å²	247	140.4 Å²	140.4	93%	0.932	78%	0.781	S	S	*	*			trans	-142.4	143.2	165.1	-75	-175.6	173.7	-170.9	-2.8	107.4
574	S	27.6	Very low	27	Very low	99 Å²	99	139.7 Å²	139.7	69%	0.692	78%	0.782	S	S	*	*			cis	-139.1	-108.2	-12.4	26.5	0	0	0	0	110.9
575	N	27.4	Very low	27	Very low	118 Å²	118	140.5 Å²	140.5	63%	0.631	79%	0.786	S	S	*	*			cis	-161.1	169.1	-7.1	-151.7	61.8	0	0	0	110.5
576	D	26.4	Very low	27	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	78%	0.783	S	S	*	*			trans	70.1	157.2	165.3	-63.9	-56.2	0	0	0	121.8
577	S	26.3	Very low	27.1	Very low	120 Å²	120	142.8 Å²	142.8	84%	0.839	79%	0.794	S	S	*	*			trans	79.5	85.2	170.2	-60.3	0	0	0	0	119.6
578	Y	26.9	Very low	27.1	Very low	226 Å²	226	142.5 Å²	142.5	89%	0.886	80%	0.797	S	S	*	*			trans	-10.9	136.6	141.8	-105.1	-108.4	0	0	0	118.2
579	S	26.2	Very low	27.2	Very low	118 Å²	118	140.4 Å²	140.4	83%	0.825	80%	0.8	S	S	*	*				-178.8	138.2	117.1	31.7	0	0	0	0	112
580	D	26.7	Very low	27.3	Very low	158 Å²	158	137.5 Å²	137.5	85%	0.845	80%	0.799	S	S	*	*			trans	-77.2	150.1	166.4	-83.8	-68.6	0	0	0	111.4
581	S	27.2	Very low	27.4	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	80%	0.802	S	S	*	*			trans	-154.2	115.8	147.9	-161.3	0	0	0	0	111.7	T583	S581-T583 PolarHBondContact OG-OG1 2.9Å
582	C	27	Very low	27.7	Very low	132 Å²	132	139 Å²	139	89%	0.892	80%	0.796	S	S	*	*			trans	-98	115.5	161.5	-172.4	0	0	0	0	107.5
583	T	28	Very low	28.3	Very low	126 Å²	126	141.3 Å²	141.3	77%	0.773	80%	0.798	S	S	*	*			trans	-148.2	156.5	173.4	23.3	0	0	0	0	112.9	S581	S581-T583 PolarHBondContact OG-OG1 2.9Å
584	D	26.2	Very low	28.5	Very low	142 Å²	142	140.4 Å²	140.4	76%	0.759	80%	0.796	S	S	*	*			trans	-83.6	161.1	-172	-112.9	-46.9	0	0	0	114.8
585	I	28.6	Very low	28.6	Very low	141 Å²	141	142.7 Å²	142.7	72%	0.723	80%	0.8	S	S	*	*			trans	47.4	113.1	148.9	-56.4	157.9	0	0	0	118.8
586	V	27.8	Very low	28.8	Very low	124 Å²	124	143.4 Å²	143.4	75%	0.752	81%	0.808	S	S	*	*			trans	-140	129.8	134.1	172.6	0	0	0	0	110.8	T588	V586-T588 HydrophobicContact CG1-CG2 4Å
587	R	28.7	Very low	28.9	Very low	243 Å²	243	145.8 Å²	145.8	92%	0.917	81%	0.812	S	S	*	*			trans	-87.2	126.2	156.9	-82.6	175.7	164.2	173.6	-5.6	109.1
588	T	27.6	Very low	28.9	Very low	127 Å²	127	149 Å²	149	78%	0.779	81%	0.813	S	S	*	*			trans	-140.5	145.9	159.1	34.4	0	0	0	0	110.8	V586	V586-T588 HydrophobicContact CG1-CG2 4Å
589	A	30.5	Very low	28.9	Very low	99 Å²	99	147.6 Å²	147.6	82%	0.818	81%	0.812	S	S	*	*			trans	-85.8	139	-175.1	0	0	0	0	0	111.9
590	T	28.3	Very low	30.3	Very low	138 Å²	138	147.2 Å²	147.2	85%	0.847	81%	0.806	S	S	*	*			trans	-95.4	116.4	172.2	32.6	0	0	0	0	111.1
591	V	30.9	Very low	30.3	Very low	136 Å²	136	146 Å²	146	82%	0.824	80%	0.804	S	S	*	*			trans	-112.2	116.3	164.4	177.5	0	0	0	0	107.8	P593	V591-P593 WeakPolarHBondContact O-CD 3.47Å
592	S	30.6	Very low	30.4	Very low	104 Å²	104	144.7 Å²	144.7	73%	0.727	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81.4	129.1	-178.1	-55.5	0	0	0	0	112.2
593	P	40.3	Very low	30.4	Very low	125 Å²	125	146.8 Å²	146.8	81%	0.812	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-91.8	131.8	161.2	33.4	-28.6	0	0	0	110.7	V591	V591-P593 WeakPolarHBondContact O-CD 3.47Å
594	Y	29	Very low	30.4	Very low	228 Å²	228	148 Å²	148	89%	0.894	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-90.7	150.6	175	-120.5	-91.5	0	0	0	112.4
595	L	29.4	Very low	30.4	Very low	147 Å²	147	148.7 Å²	148.7	77%	0.77	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-64.9	128.3	-174.3	178.7	74.3	0	0	0	114.2
596	V	31.4	Very low	30.3	Very low	133 Å²	133	149 Å²	149	81%	0.806	81%	0.805	S	S	*	*			trans	-134.2	142.1	158.1	-176.5	0	0	0	0	109.9
597	K	28.6	Very low	30.3	Very low	190 Å²	190	151.5 Å²	151.5	83%	0.826	81%	0.809	S	S	*	*			trans	-85.1	143.9	-174.3	-63.7	174.5	179.8	174.3	0	112.5
598	H	27.4	Very low	31.4	Very low	186 Å²	186	144.4 Å²	144.4	86%	0.861	79%	0.794	S	S	*	*			trans	-111.3	141.3	165.7	-98.3	-70	0	0	0	111.8
599	K	27.5	Very low	31.5	Very low	198 Å²	198	142 Å²	142	86%	0.861	79%	0.787	S	S	*	*			trans	165.9	155.2	139.1	-98.1	-173.4	176.3	-177.2	0	110.4
600	P	54.6	Low	31.4	Very low	109 Å²	109	145.9 Å²	145.9	71%	0.708	79%	0.788	S	S	*	*			cis	-138.4	-169.8	-45.6	33.6	-13.4	0	0	0	112
601	V	27.2	Very low	31.4	Very low	132 Å²	132	144.7 Å²	144.7	80%	0.8	79%	0.785	S	S	*	*				154	144.2	129.3	161.1	0	0	0	0	112
602	A	28.1	Very low	31.3	Very low	79 Å²	79	142.5 Å²	142.5	65%	0.653	78%	0.781	S	S	*	*			trans	66.2	123.1	167.6	0	0	0	0	0	117.1
603	M	27.6	Very low	32.2	Very low	176 Å²	176	142.9 Å²	142.9	87%	0.867	78%	0.781	S	S	*	*				73.5	138.8	69.2	-74	175.4	172.1	0	0	113.2
604	Q	28	Very low	32	Very low	152 Å²	152	144.8 Å²	144.8	71%	0.71	78%	0.779	S	S	*	*			cis	-162.8	161.2	-2.4	165.1	171.8	-6.5	0	0	110.9
605	M	25.8	Very low	32.1	Very low	155 Å²	155	141.6 Å²	141.6	76%	0.764	77%	0.774	S	S	*	*			trans	-1.4	135.4	166.7	-61.8	164.4	163.7	0	0	120.6
606	T	26.9	Very low	32.2	Very low	149 Å²	149	142.1 Å²	142.1	91%	0.914	78%	0.777	S	S	*	*				-167.6	164.9	111.4	15.2	0	0	0	0	114.2
607	Q	27.4	Very low	33.1	Very low	176 Å²	176	141 Å²	141	82%	0.822	77%	0.772	S	S	*	*			trans	-134.6	-178.6	179.1	-107.4	-164.6	20.4	0	0	107.4
608	P	51.8	Low	33.3	Very low	94 Å²	94	139.4 Å²	139.4	61%	0.61	77%	0.768	S	S	*	*			cis	-139.4	169.7	-34.9	38.9	-22.1	0	0	0	114.9
609	A	29.4	Very low	33.3	Very low	76 Å²	76	138.3 Å²	138.3	63%	0.628	77%	0.765	S	S	*	*			trans	53.7	166.3	137.6	0	0	0	0	0	124.8
610	H	28.8	Very low	33.4	Very low	181 Å²	181	134 Å²	134	84%	0.838	76%	0.759	S	S	*	*			trans	75.1	147.6	168.9	-48.1	-68.9	0	0	0	116.3
611	S	29.7	Very low	32.3	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	77%	0.767	S	S	*	*			cis	-157.3	166.3	-4.9	38.6	0	0	0	0	112.3
612	A	28.9	Very low	32.5	Very low	89 Å²	89	141 Å²	141	74%	0.736	76%	0.764	S	S	*	*			trans	-70.2	179.3	165.3	0	0	0	0	0	111.5
613	P	47.6	Very low	32.7	Very low	112 Å²	112	144.6 Å²	144.6	73%	0.727	77%	0.772	S	S	*	*			cis	-146.3	-171.8	17	39.3	-15.9	0	0	0	117.8
614	Q	36.1	Very low	32.8	Very low	165 Å²	165	139.4 Å²	139.4	77%	0.771	76%	0.764	S	S	*	*				135.8	150.5	115.4	-142.3	178.5	66.7	0	0	117.1
615	M	31.6	Very low	33.1	Very low	162 Å²	162	137.1 Å²	137.1	80%	0.798	77%	0.771	S	S	*	*			trans	96.6	142.8	160	-56.8	-56.6	-97.8	0	0	121.3
616	L	32	Very low	34.3	Very low	158 Å²	158	135.8 Å²	135.8	83%	0.827	77%	0.774	S	S	*	*			trans	-86	178.4	-179	-79.1	157.3	0	0	0	110.8
617	P	49.6	Very low	34.7	Very low	108 Å²	108	136.9 Å²	136.9	70%	0.701	77%	0.769	S	S	*	*			cis	-146.2	171.7	20.4	30.5	-4.7	0	0	0	120.9
618	H	32.5	Very low	35.6	Very low	158 Å²	158	133.7 Å²	133.7	73%	0.731	76%	0.763	S	S	*	*			trans	64.4	106.1	142.5	-82.5	-73.2	0	0	0	125
619	M	27.9	Very low	34.4	Very low	163 Å²	163	135.5 Å²	135.5	80%	0.803	77%	0.772	S	S	*	*				82.7	149.5	121.4	-83.2	178.2	70.3	0	0	123.5
620	S	30.6	Very low	34.7	Very low	107 Å²	107	138 Å²	138	75%	0.748	78%	0.78	S	S	*	*			trans	-143.2	156.8	-171.7	40.9	0	0	0	0	112.8
621	R	30.3	Very low	35.5	Very low	232 Å²	232	134.5 Å²	134.5	88%	0.875	77%	0.773	S	S	*	*			trans	178.9	142.4	154.7	-99.9	161.6	178.8	-162.6	-1.7	108.2
622	Q	32.7	Very low	35.5	Very low	156 Å²	156	134 Å²	134	73%	0.729	77%	0.77	S	S	*	*			cis	108.3	113.5	10.9	-171.5	178.9	40.4	0	0	114.8
623	N	31.6	Very low	35.6	Very low	154 Å²	154	135 Å²	135	82%	0.824	77%	0.771	S	S	*	*			trans	63.5	153	166	-56.8	-5.4	0	0	0	117.9
624	G	29.4	Very low	34.7	Very low	68 Å²	68	135.8 Å²	135.8	70%	0.701	77%	0.774	S	S	*	*			cis	158.6	153.4	-10.8	0	0	0	0	0	114.5
625	A	35.1	Very low	34.3	Very low	103 Å²	103	135.9 Å²	135.9	85%	0.851	78%	0.78	S	S	*	*			trans	68	170.4	171.1	0	0	0	0	0	117.9
626	P	49.5	Very low	34.3	Very low	127 Å²	127	131.5 Å²	131.5	83%	0.825	78%	0.777	S	S	*	*			cis	-128.4	179.8	-15.9	28.7	-6.5	0	0	0	115.8
627	Q	37	Very low	35.5	Very low	173 Å²	173	129.5 Å²	129.5	81%	0.808	77%	0.773	S	S	*	*			trans	-71.4	159.2	167.9	-80.1	-97.7	-26.4	0	0	112.8
628	P	44.8	Very low	34.5	Very low	108 Å²	108	131.4 Å²	131.4	70%	0.701	78%	0.777	S	S	*	*				-158.8	154.1	93.5	42	-22.1	0	0	0	120.1
629	V	27.6	Very low	34.6	Very low	133 Å²	133	132.1 Å²	132.1	81%	0.806	78%	0.78	S	S	*	*			trans	60.8	156.3	145.7	-56.4	0	0	0	0	124.7
630	T	36.4	Very low	34.5	Very low	127 Å²	127	127.6 Å²	127.6	78%	0.779	78%	0.775	S	S	*	*			trans	-89.1	-177	177.8	52.4	0	0	0	0	110.7
631	P	44.5	Very low	35.1	Very low	108 Å²	108	128.2 Å²	128.2	70%	0.701	78%	0.776	S	S	*	*			cis	-157.5	173.6	35.6	47.7	-24.9	0	0	0	122.2
632	S	30.8	Very low	35	Very low	104 Å²	104	123.1 Å²	123.1	73%	0.727	77%	0.773	S	S	*	*			trans	40.3	163.2	138.6	73.1	0	0	0	0	125.4
633	S	29.3	Very low	34.6	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	78%	0.775	S	S	*	*			trans	78.7	155.6	172.2	79.2	0	0	0	0	116
634	T	29.3	Very low	34.2	Very low	130 Å²	130	115.1 Å²	115.1	80%	0.798	77%	0.769	S	S	*	*			cis	-144.7	155.8	17.3	-21.9	0	0	0	0	113.1
635	N	28.5	Very low	34.1	Very low	166 Å²	166	122.5 Å²	122.5	89%	0.888	78%	0.776	S	S	*	*			trans	-68.2	139.9	151.7	-79.9	-35	0	0	0	109.4
636	G	31.3	Very low	33.8	Very low	71 Å²	71	124.8 Å²	124.8	73%	0.732	78%	0.782	S	S	*	*			trans	-171	105.8	175.7	0	0	0	0	0	113.3
637	P	57	Low	33.8	Very low	116 Å²	116	120.2 Å²	120.2	75%	0.753	76%	0.758	S	S	*	*			trans	-90.5	162.1	174	35.7	-32.2	0	0	0	111.4
638	L	29.5	Very low	34	Very low	148 Å²	148	116.8 Å²	116.8	78%	0.775	75%	0.75	S	S	*	*				-176.5	147.5	126.6	-117.4	75	0	0	0	110.2
639	H	32.7	Very low	33.6	Very low	173 Å²	173	115.2 Å²	115.2	80%	0.801	75%	0.754	S	S	*	*			trans	38.7	103	150.6	-69.8	-137.9	0	0	0	118.9
640	G	27.1	Very low	34	Very low	67 Å²	67	114.2 Å²	114.2	69%	0.691	75%	0.751	S	S	*	*			trans	-88.4	-172.4	131.6	0	0	0	0	0	110.2
641	P	43.5	Very low	33.8	Very low	121 Å²	121	112.8 Å²	112.8	79%	0.786	75%	0.752	S	S	*	*			cis	-107.4	-170.8	-19.4	41.2	-29	0	0	0	109.9
642	P	28.2	Very low	33.2	Very low	124 Å²	124	112 Å²	112	81%	0.805	75%	0.754	S	S	*	*				-136.4	-169	81.4	36.6	-20.7	0	0	0	112.8
643	G	23.3	Very low	33.5	Very low	74 Å²	74	111.6 Å²	111.6	76%	0.763	76%	0.757	S	S	*	*			trans	-51	148.9	-170.5	0	0	0	0	0	115.6
644	G	23.8	Very low	33.6	Very low	68 Å²	68	118.5 Å²	118.5	70%	0.701	77%	0.767	S	S	*	*			cis	101.4	163.5	18.7	0	0	0	0	0	111.6
645	W	27	Very low	34.5	Very low	224 Å²	224	117.5 Å²	117.5	85%	0.848	76%	0.763	S	S	*	*			trans	64.7	90.6	179.3	-57.1	84.3	0	0	0	117.1	G647	W645-G647 WeakPolarHBondContact CB-O 3.12Å; W645-G647 PolarHBondContact O-N 2.59Å
646	P	29.9	Very low	34.9	Very low	150 Å²	150	117 Å²	117	97%	0.974	76%	0.755	S	S	*	*	S	Bend	trans	-70.9	71.2	138.9	34.1	-31.6	0	0	0	108.2
647	G	47.7	Very low	34.9	Very low	31 Å²	31	122.3 Å²	122.3	32%	0.32	76%	0.758	S	S	.	*			trans	-178.3	104.3	-174.9	0	0	0	0	0	109.2	W645	W645-G647 WeakPolarHBondContact CB-O 3.12Å; W645-G647 PolarHBondContact O-N 2.59Å
648	P	41.9	Very low	33.9	Very low	101 Å²	101	121.3 Å²	121.3	66%	0.656	75%	0.754	S	S	*	*				-148.2	172.8	71.4	45.4	-31.7	0	0	0	115.4	P650	P648-P650 HydrophobicContact CG-CB 4.15Å; P648-P650 HydrophobicContact CG-CG 4.1Å
649	G	35.8	Very low	34.1	Very low	76 Å²	76	120.2 Å²	120.2	78%	0.784	75%	0.749	S	S	*	*	S	Bend		-85.9	119.5	127.5	0	0	0	0	0	106.8
650	P	35.9	Very low	34.4	Very low	112 Å²	112	118.8 Å²	118.8	73%	0.727	74%	0.742	S	S	*	*			trans	-65.5	141.6	-146.1	-25.8	34.6	0	0	0	120	P648	P648-P650 HydrophobicContact CG-CB 4.15Å; P648-P650 HydrophobicContact CG-CG 4.1Å
651	A	33.9	Very low	35	Very low	97 Å²	97	122.8 Å²	122.8	80%	0.802	74%	0.743	S	S	*	*			trans	64.4	170.6	152.2	0	0	0	0	0	117.1
652	A	32.1	Very low	34.8	Very low	91 Å²	91	123.2 Å²	123.2	75%	0.752	74%	0.743	S	S	*	*			cis	-143.3	130.3	-5	0	0	0	0	0	107.7
653	A	35.2	Very low	35.1	Very low	96 Å²	96	121.5 Å²	121.5	79%	0.793	74%	0.739	S	S	*	*				64.4	102.7	75.4	0	0	0	0	0	117.2
654	R	31.6	Very low	37.2	Very low	252 Å²	252	123.2 Å²	123.2	95%	0.951	74%	0.737	S	S	*	*			trans	-168	157	137.8	-111.9	-177.3	167.1	-148.2	-7.4	114.1
655	P	48.4	Very low	37.8	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	75%	0.746	S	S	*	*			trans	-136.4	-157.8	-164.9	43.9	-24.8	0	0	0	116.7
656	Q	36.4	Very low	38.1	Very low	155 Å²	155	122.6 Å²	122.6	72%	0.724	74%	0.74	S	S	*	*			trans	94.9	150	173.7	-52.4	-171.6	-106.1	0	0	115.9
657	F	31.3	Very low	38.3	Very low	183 Å²	183	120 Å²	120	80%	0.803	73%	0.732	S	S	*	*			cis	-136.7	-172.6	22.6	-112.2	-84.1	0	0	0	114.9
658	S	36.7	Very low	37.5	Very low	95 Å²	95	127.9 Å²	127.9	66%	0.664	76%	0.757	S	S	*	*			trans	-100.1	176.5	-170.8	60.8	0	0	0	0	114.9
659	N	34.8	Very low	36.9	Very low	125 Å²	125	128.9 Å²	128.9	67%	0.668	76%	0.761	S	S	*	*			cis	-150.1	-153.5	28.4	-140.6	21.1	0	0	0	112.4
660	Q	37.3	Very low	36.6	Very low	142 Å²	142	133.6 Å²	133.6	66%	0.664	77%	0.765	S	S	*	*			cis	-147.5	-113.7	16.6	-166.3	90.1	18	0	0	114.9
661	Q	40.8	Very low	36.2	Very low	152 Å²	152	133 Å²	133	71%	0.71	76%	0.764	S	S	*	*			trans	-159.9	174	-151.7	-73.9	171.7	-55	0	0	112.1
662	V	39.5	Very low	35.9	Very low	130 Å²	130	136.4 Å²	136.4	79%	0.788	76%	0.763	S	S	*	*			cis	-176.6	156	-13.8	139.3	0	0	0	0	108.4
663	A	33	Very low	35.5	Very low	87 Å²	87	140.6 Å²	140.6	72%	0.719	77%	0.767	S	S	*	*			cis	-156.8	-72.6	-34.2	0	0	0	0	0	117
664	P	68.2	Low	35.3	Very low	110 Å²	110	145.7 Å²	145.7	71%	0.714	77%	0.772	S	S	*	*				-140.9	169.9	-129.8	44.5	-27.9	0	0	0	123.2
665	Q	36.3	Very low	36.3	Very low	192 Å²	192	139 Å²	139	90%	0.897	76%	0.761	S	S	*	*			trans	86.4	147.6	159.2	-61.6	-163.3	-0.3	0	0	120.7
666	A	34	Very low	36.2	Very low	87 Å²	87	139.5 Å²	139.5	72%	0.719	76%	0.764	S	S	*	*			cis	-169.3	143	-21.3	0	0	0	0	0	116.3
667	A	32.7	Very low	35.9	Very low	97 Å²	97	140.2 Å²	140.2	80%	0.802	77%	0.771	S	S	*	*			trans	63.7	145.1	134.7	0	0	0	0	0	128.2
668	K	32.7	Very low	35.7	Very low	196 Å²	196	134.9 Å²	134.9	85%	0.852	77%	0.768	S	S	*	*			trans	96.6	109.2	145.9	-82.4	-173.9	178.5	-178.5	0	125.4
669	T	29.1	Very low	35.3	Very low	121 Å²	121	133.8 Å²	133.8	74%	0.742	77%	0.771	S	S	*	*				63.8	126.7	128.8	56.5	0	0	0	0	127.1
670	M	28.5	Very low	35	Very low	175 Å²	175	138.5 Å²	138.5	86%	0.862	79%	0.786	S	S	*	*			trans	88.4	135.6	132.3	-79	-67.5	-170.1	0	0	125.5
671	S	26.9	Very low	34.5	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	79%	0.792	S	S	*	*			trans	67.7	115.3	141.6	60.6	0	0	0	0	125.9
672	Q	28	Very low	33.9	Very low	168 Å²	168	132.1 Å²	132.1	79%	0.785	80%	0.799	S	S	*	*				59.2	145.2	122.7	-74	-72.3	13.5	0	0	126.1
673	Q	25.1	Very low	33.3	Very low	180 Å²	180	129.8 Å²	129.8	84%	0.841	80%	0.802	S	S	*	*			trans	84.6	146.3	146.3	-83.6	174.1	-40.6	0	0	125.2
674	F	30.7	Very low	33.2	Very low	202 Å²	202	131.4 Å²	131.4	89%	0.886	81%	0.808	S	S	*	*			trans	-76.5	178.6	178.5	-89	-93.8	0	0	0	113.9
675	P	52.5	Low	31.4	Very low	113 Å²	113	131.8 Å²	131.8	73%	0.734	81%	0.813	S	S	*	*			cis	-115.9	-120	7	31.5	-8	0	0	0	113.5
676	P	46.2	Very low	31.2	Very low	120 Å²	120	130.4 Å²	130.4	78%	0.779	81%	0.812	S	S	*	*			cis	-120.6	-171.8	15.4	44.3	-29.9	0	0	0	116.9
677	I	29.2	Very low	30.9	Very low	170 Å²	170	133.3 Å²	133.3	87%	0.872	82%	0.821	S	S	*	*			trans	-59.6	157.4	168.2	-65.7	152.8	0	0	0	113
678	G	28.4	Very low	30.6	Very low	70 Å²	70	136.6 Å²	136.6	72%	0.722	82%	0.818	S	S	*	*			cis	148.3	179.6	-1	0	0	0	0	0	113.2
679	G	27.9	Very low	30.4	Very low	72 Å²	72	131.9 Å²	131.9	74%	0.742	81%	0.809	S	S	*	*			trans	97.6	125.8	179.9	0	0	0	0	0	113.3
680	F	27.8	Very low	30.6	Very low	224 Å²	224	134 Å²	134	98%	0.982	81%	0.811	S	S	*	*				76.7	130.9	51.4	-89.7	-83.7	0	0	0	116
681	G	27.9	Very low	30.8	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	81%	0.809	S	S	*	*			trans	95.8	125.6	-174.4	0	0	0	0	0	111.9
682	G	26.8	Very low	31.5	Very low	85 Å²	85	135.1 Å²	135.1	88%	0.876	82%	0.816	S	S	*	*			cis	99.9	107	4.4	0	0	0	0	0	111.9
683	G	27.6	Very low	31.6	Very low	82 Å²	82	133.3 Å²	133.3	85%	0.845	82%	0.817	S	S	*	*			trans	166.5	105.5	-179.9	0	0	0	0	0	113.7
684	S	30.8	Very low	31.8	Very low	120 Å²	120	128.4 Å²	128.4	84%	0.839	81%	0.814	S	S	*	*			trans	-73.4	154.6	173	-32.8	0	0	0	0	112.2
685	S	30.6	Very low	31.8	Very low	119 Å²	119	124 Å²	124	83%	0.832	82%	0.816	S	S	*	*			trans	-176.4	152.2	132.2	34.3	0	0	0	0	112.8
686	N	31.2	Very low	31	Very low	162 Å²	162	122.9 Å²	122.9	87%	0.866	82%	0.816	S	S	*	*			trans	-95.8	146	170.9	-53	-57.7	0	0	0	110
687	T	27.6	Very low	31.2	Very low	149 Å²	149	123.3 Å²	123.3	91%	0.914	82%	0.818	S	S	*	*			trans	-145.7	167.5	145.6	-14.7	0	0	0	0	111.6
688	F	27.6	Very low	31.7	Very low	166 Å²	166	121.5 Å²	121.5	73%	0.728	82%	0.815	S	S	*	*			trans	-127	178.4	-160.1	165	-95	0	0	0	110.6
689	S	28.7	Very low	33.1	Very low	96 Å²	96	123.5 Å²	123.5	67%	0.671	82%	0.815	S	S	*	*			trans	72.3	158.3	171.6	80	0	0	0	0	116.4
690	Q	31.7	Very low	33.1	Very low	166 Å²	166	126.8 Å²	126.8	78%	0.776	82%	0.822	S	S	*	*			cis	-164.1	-179	-42.1	-115.1	177.4	24.9	0	0	106.8
691	M	33.7	Very low	33.2	Very low	169 Å²	169	124 Å²	124	83%	0.833	82%	0.817	S	S	*	*			trans	-67.5	165.5	176.3	-52.2	179.8	-159.1	0	0	112.8
692	P	40.6	Very low	33.4	Very low	129 Å²	129	123.8 Å²	123.8	84%	0.838	81%	0.814	S	S	*	*				-132.8	159.4	124.9	38	-30.9	0	0	0	114.3
693	T	31	Very low	33.7	Very low	131 Å²	131	126.1 Å²	126.1	80%	0.804	81%	0.812	S	S	*	*			trans	-115.3	135.4	179.2	52.1	0	0	0	0	112.6
694	G	29.7	Very low	33.8	Very low	76 Å²	76	129 Å²	129	78%	0.784	81%	0.808	S	S	*	*			trans	106.4	160.7	131.7	0	0	0	0	0	120.8
695	A	29.8	Very low	33.6	Very low	111 Å²	111	132.2 Å²	132.2	92%	0.917	80%	0.803	S	S	*	*			trans	79.6	144.9	167	0	0	0	0	0	119.6
696	A	36.7	Very low	34.4	Very low	89 Å²	89	132 Å²	132	74%	0.736	80%	0.799	S	S	*	*			trans	-140.5	-176.2	-179.3	0	0	0	0	0	109.3
697	P	49.5	Very low	34.3	Very low	128 Å²	128	131.6 Å²	131.6	83%	0.831	79%	0.792	S	S	*	*				-143.1	165.6	124.9	36.8	-23.2	0	0	0	115.7
698	T	39.4	Very low	34.3	Very low	133 Å²	133	132.9 Å²	132.9	82%	0.816	79%	0.79	S	S	*	*			trans	-117.8	175.2	169.3	62.2	0	0	0	0	109.5
699	P	58.2	Low	34.3	Very low	111 Å²	111	132.4 Å²	132.4	72%	0.721	80%	0.795	S	S	*	*				-159.1	168.3	85.9	41.5	-21.9	0	0	0	117.9
700	T	27.8	Very low	34.9	Very low	142 Å²	142	133.2 Å²	133.2	87%	0.871	80%	0.798	S	S	*	*			trans	-165	151.7	130.8	7.1	0	0	0	0	111.9
701	N	29.6	Very low	34.7	Very low	165 Å²	165	137.2 Å²	137.2	88%	0.882	81%	0.805	S	S	*	*			trans	-56.9	161.2	-171.8	-53	-27.1	0	0	0	114.9
702	G	32.3	Very low	34.2	Very low	70 Å²	70	135 Å²	135	72%	0.722	80%	0.802	S	S	*	*			cis	140.2	154	6.6	0	0	0	0	0	110.2
703	T	34.2	Very low	33.5	Very low	135 Å²	135	133.4 Å²	133.4	83%	0.828	79%	0.794	S	S	*	*			cis	-142.1	-134.6	1.5	-30.8	0	0	0	0	108.8
704	N	29.4	Very low	33.3	Very low	143 Å²	143	134.7 Å²	134.7	77%	0.765	80%	0.795	S	S	*	*			cis	-152.6	-169	2.5	-157.9	4.8	0	0	0	111.2
705	Y	26.5	Very low	33.2	Very low	187 Å²	187	137.7 Å²	137.7	73%	0.733	79%	0.793	S	S	*	*			trans	-136.1	177.8	-164.7	-90	-96.7	0	0	0	113.1
706	P	46.9	Very low	33.1	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	78%	0.781	S	S	*	*			cis	-140.3	140.8	17.5	38.7	-17.6	0	0	0	121.1
707	Q	29.5	Very low	32.8	Very low	155 Å²	155	141.6 Å²	141.6	72%	0.724	79%	0.79	S	S	*	*				29.9	131.4	119.4	-153	-171.5	41.8	0	0	122.2
708	M	26.8	Very low	31.7	Very low	176 Å²	176	138.2 Å²	138.2	87%	0.867	78%	0.778	S	S	*	*				179.5	171.7	117.4	-89.7	-133.7	174.9	0	0	114.8
709	N	28.7	Very low	31.4	Very low	156 Å²	156	142.8 Å²	142.8	83%	0.834	78%	0.782	S	S	*	*			trans	-88.7	175.2	-163.3	-128.8	20.3	0	0	0	114.2
710	P	42	Very low	30	Very low	113 Å²	113	144.2 Å²	144.2	73%	0.734	78%	0.784	S	S	*	*			trans	-79	156.8	-155.3	32.4	-38.1	0	0	0	116
711	R	25.8	Very low	30.1	Very low	249 Å²	249	144.1 Å²	144.1	94%	0.94	78%	0.783	S	S	*	*			trans	-137.9	166.6	165.7	-83.8	-168.5	173.5	-172.5	-1	111.9
712	T	24.6	Very low	30.2	Very low	123 Å²	123	141 Å²	141	76%	0.755	77%	0.774	S	S	*	*			trans	-77.2	165.7	-172.9	49	0	0	0	0	115.1
713	S	26.1	Very low	30.2	Very low	96 Å²	96	146.4 Å²	146.4	67%	0.671	78%	0.781	S	S	*	*			trans	78.1	119.7	139.8	54.4	0	0	0	0	122.1
714	L	26.5	Very low	30.1	Very low	157 Å²	157	145.4 Å²	145.4	82%	0.822	78%	0.779	S	S	*	*			trans	83.9	160.5	141.2	-97.7	79.3	0	0	0	121.4
715	N	27.2	Very low	30.1	Very low	140 Å²	140	142.4 Å²	142.4	75%	0.749	78%	0.782	S	S	*	*			trans	74	137.8	164.7	-83.6	17.7	0	0	0	118.2
716	T	26.8	Very low	30.3	Very low	110 Å²	110	137 Å²	137	68%	0.675	78%	0.784	S	S	*	*			cis	-152.5	150.9	-13.2	-40.5	0	0	0	0	109
717	N	30.9	Very low	29.5	Very low	172 Å²	172	140.8 Å²	140.8	92%	0.92	79%	0.791	S	S	*	*			trans	-151.3	131.8	135.7	-125.4	0.9	0	0	0	108.4
718	G	27.1	Very low	29.3	Very low	56 Å²	56	143.1 Å²	143.1	58%	0.577	80%	0.799	S	S	*	*			trans	-140.3	156.6	-175.8	0	0	0	0	0	111.6
719	Y	32.1	Very low	30.1	Very low	229 Å²	229	139.9 Å²	139.9	90%	0.898	79%	0.791	S	S	*	*			trans	-146.9	156.8	163	-108.3	-78.5	0	0	0	109.2
720	D	29	Very low	31.6	Very low	141 Å²	141	138 Å²	138	75%	0.754	79%	0.788	S	S	*	*			trans	-63.2	148	-166.6	-64.5	-86.8	0	0	0	115.9
721	T	30.7	Very low	30.9	Very low	140 Å²	140	144.4 Å²	144.4	86%	0.859	80%	0.797	S	S	*	*				-171.3	150.4	101.3	-69.2	0	0	0	0	110.1
722	S	31.2	Very low	31.2	Very low	99 Å²	99	136 Å²	136	69%	0.692	78%	0.781	S	S	*	*			trans	-98.1	147.8	-173.9	55.6	0	0	0	0	114
723	Q	32.6	Very low	31.5	Very low	184 Å²	184	135.9 Å²	135.9	86%	0.86	78%	0.78	S	S	*	*				-176.8	166.8	123.9	-98.3	173.2	38.3	0	0	113.3
724	S	32.8	Very low	31.7	Very low	115 Å²	115	139.4 Å²	139.4	80%	0.804	79%	0.786	S	S	*	*			trans	-40.1	158.3	179.9	47.8	0	0	0	0	118.7
725	G	29.4	Very low	32	Very low	80 Å²	80	137.7 Å²	137.7	83%	0.825	78%	0.782	S	S	*	*			cis	140.4	124.8	-2	0	0	0	0	0	114.3
726	G	30	Very low	32	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	78%	0.784	S	S	*	*			trans	119.8	107.8	177.8	0	0	0	0	0	113
727	Q	29.4	Very low	32.1	Very low	191 Å²	191	143 Å²	143	89%	0.893	79%	0.794	S	S	*	*				99.8	80.4	62.1	-82.6	-172.9	4.3	0	0	115.2
728	F	25.1	Very low	33	Very low	204 Å²	204	139.7 Å²	139.7	90%	0.895	78%	0.782	S	S	*	*				27.5	159	109.2	-87.4	-53	0	0	0	121.7
729	P	44.8	Very low	33	Very low	108 Å²	108	145.3 Å²	145.3	70%	0.701	79%	0.793	S	S	*	*			cis	-142	-134.3	-6.4	46.3	-22.9	0	0	0	115
730	P	58.5	Low	33	Very low	117 Å²	117	144.9 Å²	144.9	76%	0.76	79%	0.79	S	S	*	*			trans	-138.9	-169.5	-138.9	38	-10.2	0	0	0	118.2
731	R	29.4	Very low	33.4	Very low	248 Å²	248	144.2 Å²	144.2	94%	0.936	79%	0.793	S	S	*	*			trans	140.7	171.2	157.2	-86.3	-179.8	133.7	130.2	-4.1	112.2
732	A	31.3	Very low	33.3	Very low	72 Å²	72	140.4 Å²	140.4	60%	0.595	78%	0.782	S	S	*	*			cis	-176.4	163.9	-42.6	0	0	0	0	0	111.4
733	T	31.6	Very low	33.3	Very low	121 Å²	121	144.1 Å²	144.1	74%	0.742	79%	0.788	S	S	*	*			trans	62	114.9	153	46.6	0	0	0	0	124
734	E	30.5	Very low	33.1	Very low	170 Å²	170	142 Å²	142	79%	0.794	78%	0.778	S	S	*	*				79.3	131.8	122.1	-66.1	-164.9	139.8	0	0	127.2
735	T	31.8	Very low	33	Very low	120 Å²	120	143.4 Å²	143.4	74%	0.736	77%	0.772	S	S	*	*			trans	83.6	117.2	137	48.2	0	0	0	0	126.5
736	V	28.1	Very low	32.9	Very low	130 Å²	130	146 Å²	146	79%	0.788	76%	0.763	S	S	*	*				99.4	141.9	127.3	169.8	0	0	0	0	123.2
737	W	27.2	Very low	32.9	Very low	231 Å²	231	149.3 Å²	149.3	88%	0.875	76%	0.759	S	S	*	*			trans	-58.1	177.4	178.7	-69.5	92.8	0	0	0	117.2
738	P	51.7	Low	32.8	Very low	104 Å²	104	148.3 Å²	148.3	68%	0.675	75%	0.754	S	S	*	*			cis	-133.8	-156.3	20	41.2	-18.1	0	0	0	114.5
739	Q	26.4	Very low	32.8	Very low	173 Å²	173	147.3 Å²	147.3	81%	0.808	75%	0.752	S	S	*	*			cis	-158.5	-166.8	6.2	-151.3	154	-44.9	0	0	112.2
740	W	30.9	Very low	33	Very low	221 Å²	221	146.7 Å²	146.7	84%	0.837	75%	0.748	S	S	*	*			trans	-133.4	143.1	169.1	-97.2	91.1	0	0	0	111.4
741	P	38.2	Very low	31.6	Very low	126 Å²	126	149 Å²	149	82%	0.818	75%	0.748	S	S	*	*				-145.9	-177.6	100.3	39.9	-24.3	0	0	0	113.5
742	G	29	Very low	31.6	Very low	60 Å²	60	143.6 Å²	143.6	62%	0.619	74%	0.738	S	S	*	*			cis	155	159.3	-11.3	0	0	0	0	0	115.1
743	Q	30.1	Very low	31.5	Very low	177 Å²	177	146.1 Å²	146.1	83%	0.827	74%	0.742	S	S	*	*			trans	75.9	124.2	158.9	-138.1	171.8	-17.5	0	0	122.9
744	Q	28.9	Very low	31.4	Very low	140 Å²	140	149.5 Å²	149.5	65%	0.654	74%	0.74	S	S	*	*			trans	61.8	107.4	143.6	-79.1	177.2	-53.8	0	0	126.1
745	Q	30.7	Very low	31.4	Very low	144 Å²	144	147.1 Å²	147.1	67%	0.673	73%	0.73	S	S	*	*				79.3	132.5	99.8	-167.5	170.8	-4.1	0	0	123.2
746	Q	28.2	Very low	31.3	Very low	134 Å²	134	148.2 Å²	148.2	63%	0.626	73%	0.726	S	S	*	*			trans	87.5	107.9	151	-96.1	173.4	-51.1	0	0	124.2
747	Q	28.7	Very low	31.3	Very low	145 Å²	145	149.9 Å²	149.9	68%	0.678	73%	0.725	S	S	*	*				80.6	147	117.1	-95.2	-177.1	23.5	0	0	124.8
748	Q	27.5	Very low	32.1	Very low	169 Å²	169	143.9 Å²	143.9	79%	0.79	72%	0.716	S	S	*	*			trans	92	119.2	150.6	-74.8	169.2	58.1	0	0	121.6
749	H	25.5	Very low	31	Very low	184 Å²	184	148.2 Å²	148.2	85%	0.852	73%	0.727	S	S	*	*			trans	-72.9	-176	156.9	-86.9	-89.9	0	0	0	111
750	P	49.6	Very low	31.2	Very low	95 Å²	95	144 Å²	144	62%	0.617	72%	0.722	S	S	*	*			cis	-138.5	-178.5	4.7	35.1	-13	0	0	0	117.6
751	Q	29.4	Very low	31	Very low	164 Å²	164	143.3 Å²	143.3	77%	0.766	73%	0.728	S	S	*	*			trans	78.2	128.3	135.9	-92.4	167.1	-41.2	0	0	125.1
752	N	28.8	Very low	30.3	Very low	136 Å²	136	140.8 Å²	140.8	73%	0.727	73%	0.725	S	S	*	*				107.4	110.8	124.6	-96.9	6	0	0	0	123.1
753	N	29.3	Very low	30.2	Very low	125 Å²	125	145.1 Å²	145.1	67%	0.668	73%	0.734	S	S	*	*				95.4	108.1	118.2	-146.6	39.6	0	0	0	121.9
754	R	28	Very low	30	Very low	191 Å²	191	144.2 Å²	144.2	72%	0.721	73%	0.729	S	S	*	*			trans	74.4	133.1	130.6	-93.8	178.9	156.3	-140.3	9.4	124.7
755	E	31.9	Very low	29.9	Very low	121 Å²	121	145.1 Å²	145.1	57%	0.565	73%	0.734	S	S	*	*			trans	108	109.1	131	-76.5	177.1	96.2	0	0	123.5
756	Q	28.6	Very low	29.9	Very low	143 Å²	143	144.9 Å²	144.9	67%	0.668	74%	0.737	S	S	*	*			trans	83.4	114.3	130.2	-67.1	-170.8	52.7	0	0	124.1
757	H	29	Very low	29.7	Very low	165 Å²	165	146.9 Å²	146.9	76%	0.764	75%	0.749	S	S	*	*			trans	83.5	156	134	-78.2	-51.7	0	0	0	121.6
758	P	44.3	Very low	29.9	Very low	105 Å²	105	148.9 Å²	148.9	68%	0.682	76%	0.755	S	S	*	*				-127.5	169.6	-128.9	44.4	-32.7	0	0	0	117.3
759	H	28	Very low	30.4	Very low	194 Å²	194	145.9 Å²	145.9	90%	0.898	75%	0.751	S	S	*	*			trans	-145.9	166.6	155.6	-124.5	54.6	0	0	0	112
760	A	30.2	Very low	30.6	Very low	86 Å²	86	143.4 Å²	143.4	71%	0.711	74%	0.743	S	S	*	*			trans	-138.1	130.6	-172.2	0	0	0	0	0	112.6
761	Q	27.1	Very low	29.9	Very low	205 Å²	205	145 Å²	145	96%	0.958	75%	0.752	S	S	*	*			trans	178.6	147.1	147	-104.5	171.5	12.6	0	0	111.4
762	G	24.5	Very low	30.2	Very low	73 Å²	73	145 Å²	145	75%	0.753	76%	0.756	S	S	*	*			trans	82.8	78	138.5	0	0	0	0	0	121.4
763	N	26.3	Very low	30.4	Very low	152 Å²	152	142.4 Å²	142.4	81%	0.813	75%	0.748	S	S	*	*			trans	63.6	136.1	133.5	-148.2	25.7	0	0	0	121.1
764	Q	25	Very low	30.6	Very low	157 Å²	157	145 Å²	145	73%	0.734	76%	0.758	S	S	*	*			trans	67.6	152.6	-174.9	-51.7	-171.8	13.3	0	0	113.5
765	Q	27.5	Very low	31	Very low	160 Å²	160	143.9 Å²	143.9	75%	0.748	77%	0.766	S	S	*	*			cis	-143.4	-161.6	14.4	-141	159.6	52.6	0	0	111.3
766	D	30	Very low	31	Very low	139 Å²	139	145.2 Å²	145.2	74%	0.743	78%	0.777	S	S	*	*			trans	-44	154.8	-173.3	-66.4	-100.2	0	0	0	120.1
767	M	24.8	Very low	31.1	Very low	176 Å²	176	147.4 Å²	147.4	87%	0.867	79%	0.787	S	S	*	*			trans	-166.8	118.1	131.8	-108.7	-172.2	-60.7	0	0	113.8
768	F	33.6	Very low	31.5	Very low	187 Å²	187	145.4 Å²	145.4	82%	0.82	79%	0.789	S	S	*	*			trans	-78.7	147.8	130.1	-81.3	-98.1	0	0	0	106.3
769	P	36.1	Very low	30.8	Very low	106 Å²	106	144.1 Å²	144.1	69%	0.688	79%	0.787	S	S	*	*			cis	-147.8	142.3	47.8	38	-18	0	0	0	117.3
770	D	29.9	Very low	31.2	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	79%	0.786	S	S	*	*			trans	-153	59.9	160.4	-153.4	-2.3	0	0	0	113.1	S773	D770-S773 PolarHBondContact OD1-OG 3.16Å
771	V	35.2	Very low	31.2	Very low	130 Å²	130	145.8 Å²	145.8	79%	0.788	79%	0.792	S	S	*	*	S	Bend	trans	-138.7	22	174	-150.3	0	0	0	0	112
772	L	36.5	Very low	31.3	Very low	164 Å²	164	143.1 Å²	143.1	86%	0.859	78%	0.784	S	S	*	*	S	Bend	trans	-126.7	21	-179.5	-95.1	165.6	0	0	0	112.4
773	S	32.9	Very low	31.5	Very low	81 Å²	81	145.1 Å²	145.1	57%	0.566	79%	0.787	S	S	*	*	S	Bend	trans	-111.8	7	-170.6	40.2	0	0	0	0	113.9	D770	D770-S773 PolarHBondContact OD1-OG 3.16Å
774	M	34.1	Very low	31.9	Very low	179 Å²	179	144.4 Å²	144.4	88%	0.882	78%	0.783	S	S	*	*	S	Bend	trans	-126.3	13.2	178.3	-65.5	-159.4	-56.8	0	0	114.9
775	L	35.5	Very low	32.3	Very low	167 Å²	167	144 Å²	144	87%	0.874	79%	0.785	S	S	*	*	S	Bend	trans	-128	35.3	-178.2	-117.2	92.9	0	0	0	114.3
776	D	32.7	Very low	32.6	Very low	149 Å²	149	145.8 Å²	145.8	80%	0.797	79%	0.791	S	S	*	*			trans	-150.3	92.8	161	-164.2	15	0	0	0	113.5
777	Q	30.3	Very low	32.7	Very low	189 Å²	189	148.6 Å²	148.6	88%	0.883	80%	0.8	S	S	*	*			trans	-165.7	144.6	140.8	-112.4	173	61.5	0	0	110.5
778	P	36.2	Very low	33.1	Very low	123 Å²	123	147.1 Å²	147.1	80%	0.799	79%	0.794	S	S	*	*			trans	-91	140.1	-173.2	34.6	-33.4	0	0	0	113
779	A	30.1	Very low	33	Very low	79 Å²	79	142.5 Å²	142.5	65%	0.653	79%	0.79	S	S	*	*			trans	-127.5	118.3	166.1	0	0	0	0	0	109.6	F781	A779-F781 HydrophobicContact CB-CD2 4.48Å; A779-F781 HydrophobicContact CB-CE2 4.11Å
780	S	36.7	Very low	33	Very low	124 Å²	124	144.2 Å²	144.2	87%	0.867	79%	0.792	S	S	*	*			trans	-69.7	131.6	175	-50.7	0	0	0	0	110.4
781	F	30.2	Very low	33.2	Very low	190 Å²	190	147.5 Å²	147.5	83%	0.833	80%	0.796	S	S	*	*			trans	-122.3	132.3	170.5	-86.3	-89.3	0	0	0	110.4	A779	A779-F781 HydrophobicContact CB-CD2 4.48Å; A779-F781 HydrophobicContact CB-CE2 4.11Å
782	N	28.8	Very low	33.5	Very low	149 Å²	149	146.5 Å²	146.5	80%	0.797	79%	0.793	S	S	*	*			trans	-71.1	160.3	172.6	-76	-14.4	0	0	0	110.8
783	S	30	Very low	33.8	Very low	116 Å²	116	144.4 Å²	144.4	81%	0.811	79%	0.789	S	S	*	*	S	Bend	trans	-101.4	14.6	-169.1	46.7	0	0	0	0	114.7
784	D	33.8	Very low	34	Very low	137 Å²	137	151.3 Å²	151.3	73%	0.733	80%	0.804	S	S	*	*			trans	-115.1	10.4	-159.8	-53.8	-72.7	0	0	0	115
785	D	34.7	Very low	34.5	Very low	147 Å²	147	150.3 Å²	150.3	79%	0.786	80%	0.803	S	S	*	*	S	Bend	trans	-121.2	27.5	-165.5	-139	-9.1	0	0	0	114.4
786	F	33.1	Very low	34.7	Very low	199 Å²	199	155.4 Å²	155.4	87%	0.873	82%	0.822	S	S	*	*			trans	-149.1	57.9	175.3	-91	-69.9	0	0	0	114
787	E	31.2	Very low	34.8	Very low	198 Å²	198	155.8 Å²	155.8	93%	0.925	82%	0.823	S	S	*	*			trans	-98.3	117.2	155.4	-74.5	-153.8	138.3	0	0	110.6
788	I	34.3	Very low	35.1	Very low	144 Å²	144	154 Å²	154	74%	0.738	82%	0.82	S	S	*	*			trans	-95.7	103.5	168.3	-62.1	177.5	0	0	0	107.2	I790	I788-I790 PolarHBondContact O-N 3.46Å
789	A	30.2	Very low	35	Very low	90 Å²	90	155.7 Å²	155.7	74%	0.744	82%	0.821	S	S	*	*			trans	-65.6	130.9	178.9	0	0	0	0	0	111.5
790	I	36.3	Very low	35.3	Very low	143 Å²	143	160.2 Å²	160.2	73%	0.733	83%	0.831	S	S	*	*	S	Bend	trans	-98.9	-5.2	-175.9	-72.8	174.7	0	0	0	112.8	I788	I788-I790 PolarHBondContact O-N 3.46Å
791	Y	34.5	Very low	35.2	Very low	199 Å²	199	162.5 Å²	162.5	78%	0.78	83%	0.829	S	S	*	*	S	Bend	trans	-138	145.3	175.6	-65.6	-79.1	0	0	0	111.7
792	P	41.7	Very low	35.5	Very low	110 Å²	110	160.7 Å²	160.7	71%	0.714	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-75.3	151.7	170.4	32.9	-34.6	0	0	0	111.2
793	P	42.6	Very low	36	Very low	120 Å²	120	161.5 Å²	161.5	78%	0.779	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-73.4	144.7	174.9	30.9	-34.4	0	0	0	111.8
794	Y	37.8	Very low	36.5	Very low	225 Å²	225	165 Å²	165	88%	0.882	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-75.3	147.2	161.2	-77.7	-103.4	0	0	0	109.8
795	N	44.6	Very low	36.7	Very low	159 Å²	159	167.3 Å²	167.3	85%	0.85	84%	0.841	S	S	*	*			trans	-112.9	154.4	159.7	-92.3	-7.7	0	0	0	109.2
796	E	39.4	Very low	36.9	Very low	274 Å²	274	169.2 Å²	169.2	100%	1.28	85%	0.846	S	S	*	*			trans	-74.3	0	164.9	-64.7	-180	106	0	0	112.1

Retrieved 796 of 796 residues in 1081.3 ms (Link to these results)

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