A0A060Y577_ONCMY Loading...

Small ribosomal subunit protein uS5

AlphaFold DB (B5DGA8), UniProt , Accession A0A060Y577, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110486878, Length 282 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	40	Very low	36.9	Very low	241 Å²	241	138.5 Å²	138.5	100%	1.187	88%	0.877	S	S	*	*				0	118.5	0	-85.6	71.6	174.5	0	0	107.2
2	A	39	Very low	36.5	Very low	100 Å²	100	145.6 Å²	145.6	83%	0.826	89%	0.886	S	S	*	*			cis	-144.1	152.1	27.5	0	0	0	0	0	112.6
3	D	39.1	Very low	36.5	Very low	158 Å²	158	153.5 Å²	153.5	85%	0.845	89%	0.89	S	S	*	*			trans	-63.3	158.8	177.4	-62.1	-88.8	0	0	0	115.3
4	N	39.8	Very low	36.4	Very low	167 Å²	167	148.4 Å²	148.4	89%	0.893	89%	0.886	S	S	*	*				-162.7	156.9	113.2	-144.7	-6.1	0	0	0	113.8
5	A	41.2	Very low	36.1	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	88%	0.879	S	S	*	*			trans	-88.8	166	-152.3	0	0	0	0	0	118.2
6	G	33.5	Very low	35.9	Very low	85 Å²	85	148.5 Å²	148.5	88%	0.876	89%	0.885	S	S	*	*				114.1	126.5	114.8	0	0	0	0	0	118.8
7	G	32.4	Very low	35.7	Very low	84 Å²	84	143.9 Å²	143.9	87%	0.866	88%	0.876	S	S	*	*			trans	146.4	88.5	150.9	0	0	0	0	0	117.2
8	E	37.5	Very low	35.8	Very low	191 Å²	191	143.5 Å²	143.5	89%	0.893	88%	0.881	S	S	*	*			trans	-70	150.7	164.4	-77.2	166.2	86	0	0	113.1
9	R	35.8	Very low	35.6	Very low	258 Å²	258	140.1 Å²	140.1	97%	0.974	88%	0.877	S	S	*	*			trans	175.3	140.3	133.1	-100.1	169	-174.7	-165.6	2.8	112.7
10	G	33.4	Very low	35.6	Very low	82 Å²	82	140.4 Å²	140.4	85%	0.845	87%	0.872	S	S	*	*			trans	154.2	76.6	156.3	0	0	0	0	0	115.3
11	G	34	Very low	35.8	Very low	69 Å²	69	145.3 Å²	145.3	71%	0.711	87%	0.874	S	S	*	*			trans	-83.4	156.4	169.7	0	0	0	0	0	113.3
12	F	32.5	Very low	35.5	Very low	223 Å²	223	136.9 Å²	136.9	98%	0.978	85%	0.849	S	S	*	*			trans	-142.1	130.3	153	-102.6	-86.3	0	0	0	109.6
13	R	36.3	Very low	35.3	Very low	249 Å²	249	144.7 Å²	144.7	94%	0.94	86%	0.858	S	S	*	*			trans	-130.4	140.5	-174.6	-158.1	-171.5	-163.1	-163.3	6.1	107.3
14	G	35.4	Very low	35	Very low	81 Å²	81	140.9 Å²	140.9	84%	0.835	86%	0.855	S	S	*	*			trans	134.7	128.6	164.9	0	0	0	0	0	112.7
15	G	31.1	Very low	35	Very low	76 Å²	76	145.4 Å²	145.4	78%	0.784	86%	0.86	S	S	*	*			cis	-165.4	175.8	15.6	0	0	0	0	0	114
16	F	33.8	Very low	34.7	Very low	223 Å²	223	144.7 Å²	144.7	98%	0.978	86%	0.861	S	S	*	*			trans	-87.7	164	-163.5	-84	-112.2	0	0	0	115.5
17	G	32.1	Very low	35	Very low	71 Å²	71	153.4 Å²	153.4	73%	0.732	87%	0.868	S	S	*	*			trans	150	83.5	154.5	0	0	0	0	0	113
18	S	36.8	Very low	35.2	Very low	136 Å²	136	152.8 Å²	152.8	95%	0.951	86%	0.861	S	S	*	*				77.4	123.4	87.7	-160.1	0	0	0	0	114.3
19	G	31.8	Very low	35.4	Very low	78 Å²	78	156.1 Å²	156.1	80%	0.804	87%	0.866	S	S	*	*			trans	165	68.1	174.9	0	0	0	0	0	115.3
20	D	36.8	Very low	35.4	Very low	146 Å²	146	147.3 Å²	147.3	78%	0.781	86%	0.855	S	S	*	*			trans	-52	135.6	173.7	-156	-72.8	0	0	0	114.2
21	R	40.1	Very low	35.7	Very low	244 Å²	244	154.3 Å²	154.3	92%	0.921	86%	0.855	S	S	*	*			trans	-173.6	101.4	135.3	-106.2	-177.9	-99.1	-173.2	-6.1	113.4
22	G	32.2	Very low	35.8	Very low	65 Å²	65	154.5 Å²	154.5	67%	0.67	86%	0.858	S	S	*	*				84.5	111.4	116.5	0	0	0	0	0	121.4
23	R	35.4	Very low	36.1	Very low	264 Å²	264	154.3 Å²	154.3	100%	0.996	85%	0.851	S	S	*	*			trans	75.1	122.3	137	-76.3	-178	170.9	-179.8	-2.4	120.5
24	G	33.8	Very low	36.1	Very low	77 Å²	77	146 Å²	146	79%	0.794	84%	0.842	S	S	*	*			trans	164	82.4	146.9	0	0	0	0	0	116.1
25	R	38.7	Very low	36.3	Very low	262 Å²	262	153.9 Å²	153.9	99%	0.989	85%	0.847	S	S	*	*			trans	-55.5	139.8	163.7	-81.2	176	168.6	177.4	-3.5	110.5
26	G	34.8	Very low	36.5	Very low	75 Å²	75	153.4 Å²	153.4	77%	0.773	84%	0.842	S	S	*	*			trans	178.9	83.9	166.1	0	0	0	0	0	114.8	G28	G26-G28 PolarHBondContact O-N 2.96Å
27	R	41	Very low	36.9	Very low	268 Å²	268	154.6 Å²	154.6	100%	1.011	84%	0.84	S	S	*	*			trans	-56.8	122.2	159.5	-87.8	177.9	169.2	176	-2.8	108.7
28	G	35.5	Very low	37.1	Very low	70 Å²	70	154.5 Å²	154.5	72%	0.722	84%	0.839	S	S	*	*			trans	-153.6	87.7	173.1	0	0	0	0	0	111.1	G26 G30	G26-G28 PolarHBondContact O-N 2.96Å; G28-G30 VanDerWaalsContact C-N 3.27Å; G28-G30 PolarHBondContact O-N 3.39Å
29	R	42.5	Very low	37.4	Very low	262 Å²	262	152.8 Å²	152.8	99%	0.989	83%	0.833	S	S	*	*			trans	-62.1	88.8	164	-90.8	178.6	167.2	175.5	-2.8	108.6
30	G	35.5	Very low	37.9	Very low	72 Å²	72	161 Å²	161	74%	0.742	84%	0.84	S	S	*	*			trans	-98.1	81.7	168.9	0	0	0	0	0	110.5	G28 G32	G28-G30 VanDerWaalsContact C-N 3.27Å; G28-G30 PolarHBondContact O-N 3.39Å; G30-G32 PolarHBondContact O-N 3.24Å
31	R	40.1	Very low	38.3	Very low	229 Å²	229	157.3 Å²	157.3	86%	0.864	84%	0.837	S	S	*	*			trans	-65.4	84.5	162.4	-94	-179	171.2	173.9	-2.3	107.9	R33	R31-R33 PolarHBondContact O-N 3.46Å
32	G	34.8	Very low	38.1	Very low	74 Å²	74	148.4 Å²	148.4	76%	0.763	82%	0.821	S	S	*	*			trans	-69.3	75.2	163.3	0	0	0	0	0	109.3	G30 G34	G30-G32 PolarHBondContact O-N 3.24Å; G32-G34 PolarHBondContact O-N 3.23Å
33	R	39.7	Very low	38.7	Very low	219 Å²	219	154.9 Å²	154.9	83%	0.826	83%	0.831	S	S	*	*			trans	-60.9	93.2	158.2	-91.1	-178.1	170.3	176.3	-2.9	105.6	R31 R35	R31-R33 PolarHBondContact O-N 3.46Å; R33-R35 VanDerWaalsContact C-N 3.34Å; R33-R35 PolarHBondContact O-N 2.82Å
34	G	36.8	Very low	39.3	Very low	74 Å²	74	146.7 Å²	146.7	76%	0.763	81%	0.814	S	S	*	*			trans	-50.4	107.2	162	0	0	0	0	0	106.4	G32 G36	G32-G34 PolarHBondContact O-N 3.23Å; G34-G36 VanDerWaalsContact C-N 3.29Å; G34-G36 PolarHBondContact O-N 3.31Å
35	R	39.8	Very low	40	Very low	246 Å²	246	151.1 Å²	151.1	93%	0.928	81%	0.814	S	S	*	*			trans	-52.7	103.5	170.1	-89.3	176.4	167	173.8	-4.5	105.3	R33 R37	R33-R35 VanDerWaalsContact C-N 3.34Å; R33-R35 PolarHBondContact O-N 2.82Å; R35-R37 PolarHBondContact O-N 3.47Å
36	G	35.6	Very low	40.8	Very low	67 Å²	67	146.6 Å²	146.6	69%	0.691	81%	0.809	S	S	*	*			trans	-47.9	118.1	166.1	0	0	0	0	0	105.7	G34 G38	G34-G36 VanDerWaalsContact C-N 3.29Å; G34-G36 PolarHBondContact O-N 3.31Å; G36-G38 PolarHBondContact O-N 3.32Å
37	R	42.2	Very low	42.6	Very low	248 Å²	248	151.7 Å²	151.7	94%	0.936	81%	0.81	S	S	*	*			trans	-53.4	104.8	160.3	-83.9	-178.8	171.1	-178.4	-2.9	103.9	R35 A39	R35-R37 PolarHBondContact O-N 3.47Å; R37-A39 PolarHBondContact O-N 3.4Å
38	G	35.8	Very low	44.7	Very low	69 Å²	69	146 Å²	146	71%	0.711	80%	0.795	S	S	*	*			trans	-46.9	115.1	178.4	0	0	0	0	0	106.1	G36 R40	G36-G38 PolarHBondContact O-N 3.32Å; G38-R40 PolarHBondContact O-N 3.47Å
39	A	43.3	Very low	47.4	Very low	100 Å²	100	144.8 Å²	144.8	83%	0.826	77%	0.769	S	S	*	*			trans	-59	91.9	158.8	0	0	0	0	0	104	R37 G41	R37-A39 PolarHBondContact O-N 3.4Å; A39-G41 PolarHBondContact O-N 2.86Å
40	R	42	Very low	49.7	Very low	249 Å²	249	137.4 Å²	137.4	94%	0.94	75%	0.753	S	S	*	*			trans	-64.5	69.9	154.6	-110.1	-177.8	174	176.9	-2.2	105	G38 G42	G38-R40 PolarHBondContact O-N 3.47Å; R40-G42 PolarHBondContact O-N 2.81Å
41	G	43.9	Very low	52.4	Low	70 Å²	70	134.7 Å²	134.7	72%	0.722	72%	0.722	S	S	*	*			trans	-70.1	60.3	150.8	0	0	0	0	0	106.5	A39 K43	A39-G41 PolarHBondContact O-N 2.86Å; G41-K43 VanDerWaalsContact C-N 3.34Å; G41-K43 PolarHBondContact O-N 3.39Å; G41-K43 VanDerWaalsContact O-N 3.11Å
42	G	37.2	Very low	54.8	Low	57 Å²	57	129 Å²	129	59%	0.588	71%	0.713	S	S	*	*			trans	-62.9	110.9	154.9	0	0	0	0	0	103.8	R40 S44	R40-G42 PolarHBondContact O-N 2.81Å; G42-S44 VanDerWaalsContact C-N 3.33Å; G42-S44 PolarHBondContact O-N 3.31Å
43	K	44.2	Very low	57.5	Low	200 Å²	200	127.2 Å²	127.2	87%	0.87	69%	0.687	S	S	*	*			trans	-37.3	107.6	155.1	-140.8	176.2	-177.6	-176.4	0	104.8	G41 E45	G41-K43 VanDerWaalsContact C-N 3.34Å; G41-K43 PolarHBondContact O-N 3.39Å; G41-K43 VanDerWaalsContact O-N 3.11Å; K43-E45 PolarHBondContact O-N 3.17Å
44	S	47.8	Very low	60	Low	92 Å²	92	121.7 Å²	121.7	64%	0.643	67%	0.669	S	S	*	*			trans	-71.1	86.4	177	52.8	0	0	0	0	105.5	G42	G42-S44 VanDerWaalsContact C-N 3.33Å; G42-S44 PolarHBondContact O-N 3.31Å
45	E	48.8	Very low	62.7	Low	170 Å²	170	118.3 Å²	118.3	79%	0.794	63%	0.633	S	S	*	*			trans	-42.9	139.3	154.3	-67	-179.6	157.5	0	0	107.7	K43 K47	K43-E45 PolarHBondContact O-N 3.17Å; E45-K47 PolarHBondContact O-N 2.69Å
46	D	56.1	Low	65.2	Low	167 Å²	167	106.6 Å²	106.6	89%	0.893	59%	0.589	S	S	*	*			trans	-38.8	93.2	-167.3	-57.3	-58.3	0	0	0	112	E48	D46-E48 PolarHBondContact O-N 3.42Å
47	K	72.4	Confident	67.9	Low	182 Å²	182	105.8 Å²	105.8	79%	0.791	57%	0.565	S	S	*	*			trans	-65.9	111	172.4	-81.4	-177	179.1	177.6	0	105.7	E45 W49	E45-K47 PolarHBondContact O-N 2.69Å; K47-W49 PolarHBondContact O-N 3.37Å; K47-W49 VanDerWaalsContact O-N 3.13Å
48	E	85.5	Confident	70.4	Confident	148 Å²	148	94 Å²	94	69%	0.692	52%	0.52	S	S	*	.			trans	-48	123.5	171.3	-163.4	-163	142.5	0	0	108.7	D46 V50 K60	D46-E48 PolarHBondContact O-N 3.42Å; E48-V50 PolarHBondContact O-N 3.41Å; E48-V50 VanDerWaalsContact O-N 3.15Å; E48-K60 IonicContact OE1-NZ 2.72Å; E48-K60 PolarHBondContact OE1-NZ 3.44Å
49	W	91.1	Very high	73.1	Confident	45 Å²	45	90.7 Å²	90.7	17%	0.17	49%	0.486	C	S	.	.			trans	-63.9	118.5	-176.5	168.2	40.9	0	0	0	109.7	K47 P51 V59 K60 E79 E81 I82 F85	K47-W49 PolarHBondContact O-N 3.37Å; K47-W49 VanDerWaalsContact O-N 3.13Å; W49-P51 HydrophobicContact CZ2-CB 4.1Å; W49-V59 HydrophobicContact CH2-CB 4.24Å; W49-V59 HydrophobicContact CH2-CG1 3.99Å; W49-V59 HydrophobicContact CZ3-CG1 4.3Å; W49-K60 HydrophobicContact CZ3-CB 4.24Å; W49-K60 WeakPolarHBondContact O-CD 3.46Å; W49-K60 WeakPolarHBondContact O-CE 3.47Å; W49-K60 PolarHBondContact O-NZ 3.22Å; W49-E79 WeakPolarHBondContact CZ2-OE2 3.3Å; W49-E79 PolarHBondContact NE1-OE2 3.32Å; W49-E81 HydrophobicContact CB-CB 4.4Å; W49-E81 HydrophobicContact CB-CG 4.35Å; W49-E81 HydrophobicContact CD2-CB 3.45Å; W49-E81 VanDerWaalsContact CD2-CB 3.45Å; W49-E81 HydrophobicContact CD2-CG 4.26Å; W49-E81 VanDerWaalsContact CE2-CB 3.44Å; W49-E81 HydrophobicContact CE3-CB 4.02Å; W49-E81 HydrophobicContact CG-CB 3.6Å; W49-E81 HydrophobicContact CG-CG 3.85Å; W49-E81 HydrophobicContact CZ2-CB 4.02Å; W49-I82 HydrophobicContact CH2-CB 4.41Å; W49-I82 HydrophobicContact CH2-CG1 3.7Å; W49-I82 HydrophobicContact CZ2-CG1 3.64Å; W49-F85 HydrophobicContact CZ3-CB 4.12Å; W49-F85 HydrophobicContact CZ3-CD2 4.42Å; W49-F85 HydrophobicContact CZ3-CG 4.42Å
50	V	90.8	Very high	75.4	Confident	108 Å²	108	89 Å²	89	66%	0.655	46%	0.461	S	S	*	.			trans	-106.6	106.2	173.7	-178.9	0	0	0	0	108.3	E48	E48-V50 PolarHBondContact O-N 3.41Å; E48-V50 VanDerWaalsContact O-N 3.15Å
51	P	92.5	Very high	77.8	Confident	15 Å²	15	80.2 Å²	80.2	10%	0.097	43%	0.432	C	S	.	.			trans	-70.8	138.3	-175.4	26.8	-34.1	0	0	0	111.6	W49 R57 K60 E79	W49-P51 HydrophobicContact CZ2-CB 4.1Å; P51-R57 HydrophobicContact CB-CG 4.23Å; P51-R57 HydrophobicContact CG-CB 4.44Å; P51-R57 HydrophobicContact CG-CG 3.89Å; P51-K60 VanDerWaalsContact CD-CD 3.5Å; P51-K60 HydrophobicContact CG-CB 4.07Å; P51-K60 HydrophobicContact CG-CD 3.92Å; P51-E79 WeakPolarHBondContact CA-OE2 3.04Å
52	V	90.8	Very high	80.1	Confident	110 Å²	110	83.6 Å²	83.6	67%	0.667	43%	0.431	S	S	*	.			trans	-103.5	-26.6	179.6	-64.9	0	0	0	0	111.6	R57 E79	V52-R57 PolarHBondContact O-NH1 3.11Å; V52-R57 PolarHBondContact O-NH2 3.32Å; V52-R57 VanDerWaalsContact O-NH2 3.11Å; V52-E79 HydrophobicContact CG2-CG 4.5Å; V52-E79 VanDerWaalsContact CG2-OE1 3.29Å; V52-E79 WeakPolarHBondContact CG2-OE1 3.38Å; V52-E79 PolarHBondContact N-OE1 2.85Å
53	T	91.9	Very high	82.7	Confident	35 Å²	35	84.7 Å²	84.7	22%	0.215	42%	0.42	C	S	.	.	S	Bend	trans	-87	157.6	178.6	61	0	0	0	0	112.7	L55 G56 R57 K78 E79	T53-L55 VanDerWaalsContact C-N 3.28Å; T53-G56 PolarHBondContact O-N 2.94Å; T53-G56 PolarHBondContact OG1-N 3.22Å; T53-R57 WeakPolarHBondContact O-CG 3.42Å; T53-R57 PolarHBondContact O-N 2.73Å; T53-R57 PolarHBondContact O-NH1 3.31Å; T53-K78 HydrophobicContact CG2-CB 4.39Å; T53-E79 WeakPolarHBondContact CB-OE1 3.47Å; T53-E79 HydrophobicContact CG2-CG 4.33Å; T53-E79 WeakPolarHBondContact CG2-OE1 3.47Å; T53-E79 PolarHBondContact N-OE1 2.89Å; T53-E79 PolarHBondContact OG1-OE1 2.77Å
54	K	91.7	Very high	85	Confident	104 Å²	104	75.2 Å²	75.2	45%	0.452	38%	0.378	S	S	.	.	H	α-helix	trans	-60.1	-42.6	171.8	-66.7	-179.3	178.9	-175	0	110.7	R57 L58 Y255 L262	K54-R57 PolarHBondContact O-N 3.5Å; K54-L58 WeakPolarHBondContact O-CG 3.41Å; K54-L58 PolarHBondContact O-N 3.4Å; K54-L58 VanDerWaalsContact O-N 3.12Å; K54-Y255 HydrophobicContact CB-CE1 3.99Å; K54-L262 HydrophobicContact CB-CD1 4.17Å; K54-L262 HydrophobicContact CB-CD2 4.02Å; K54-L262 HydrophobicContact CD-CD1 4.31Å; K54-L262 HydrophobicContact CG-CD1 4.45Å; K54-L262 HydrophobicContact CG-CD2 4.34Å
55	L	92.9	Very high	87	Confident	3 Å²	3	79.2 Å²	79.2	2%	0.016	38%	0.384	C	S	.	.	H	α-helix	trans	-60.6	-49.4	176.6	-174.3	62.7	0	0	0	112	T53 R57 L58 V59 I64 I70 L75 I77 I82	T53-L55 VanDerWaalsContact C-N 3.28Å; L55-R57 VanDerWaalsContact C-N 3.28Å; L55-R57 PolarHBondContact O-N 3.22Å; L55-L58 PolarHBondContact O-N 2.82Å; L55-L58 VanDerWaalsContact O-N 3.15Å; L55-V59 HydrophobicContact CD1-CG2 4.44Å; L55-V59 HydrophobicContact CG-CG2 4.5Å; L55-V59 WeakPolarHBondContact O-CG2 3.41Å; L55-V59 PolarHBondContact O-N 3.08Å; L55-I64 HydrophobicContact CD1-CD1 3.55Å; L55-I70 HydrophobicContact CD1-CD1 4.12Å; L55-I70 HydrophobicContact CD1-CG1 4.2Å; L55-I70 HydrophobicContact CD2-CD1 4.44Å; L55-I70 HydrophobicContact CD2-CG2 4.3Å; L55-L75 HydrophobicContact CD1-CD1 3.95Å; L55-L75 HydrophobicContact CD2-CB 4.41Å; L55-I77 HydrophobicContact CD2-CG1 4.47Å; L55-I82 HydrophobicContact CB-CD1 4.45Å; L55-I82 HydrophobicContact CD2-CD1 3.98Å; L55-I82 HydrophobicContact CG-CD1 4.01Å
56	G	93.4	Very high	89.1	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-58.3	-38.7	178.9	0	0	0	0	0	112.8	T53 V59 K60	T53-G56 PolarHBondContact O-N 2.94Å; T53-G56 PolarHBondContact OG1-N 3.22Å; G56-V59 PolarHBondContact O-N 3.31Å; G56-K60 WeakPolarHBondContact O-CB 3.44Å; G56-K60 PolarHBondContact O-N 3.43Å
57	R	92	Very high	90.9	Very high	49 Å²	49	65.2 Å²	65.2	19%	0.185	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-50	174.2	-68.5	177.8	-169.8	88.4	2.7	111.4	P51 V52 T53 K54 L55 V59 K60 D61	P51-R57 HydrophobicContact CB-CG 4.23Å; P51-R57 HydrophobicContact CG-CB 4.44Å; P51-R57 HydrophobicContact CG-CG 3.89Å; V52-R57 PolarHBondContact O-NH1 3.11Å; V52-R57 PolarHBondContact O-NH2 3.32Å; V52-R57 VanDerWaalsContact O-NH2 3.11Å; T53-R57 WeakPolarHBondContact O-CG 3.42Å; T53-R57 PolarHBondContact O-N 2.73Å; T53-R57 PolarHBondContact O-NH1 3.31Å; K54-R57 PolarHBondContact O-N 3.5Å; L55-R57 VanDerWaalsContact C-N 3.28Å; L55-R57 PolarHBondContact O-N 3.22Å; R57-V59 PolarHBondContact O-N 3.24Å; R57-K60 PolarHBondContact O-N 3.24Å; R57-D61 WeakPolarHBondContact O-CB 3.46Å; R57-D61 PolarHBondContact O-N 3.48Å; R57-D61 VanDerWaalsContact O-OD2 3.11Å
58	L	93.3	Very high	91.8	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-36.2	178.6	-67.8	178.9	0	0	0	113	K54 L55 M62 K63 I64 P254 Y255 F258 L262	K54-L58 WeakPolarHBondContact O-CG 3.41Å; K54-L58 PolarHBondContact O-N 3.4Å; K54-L58 VanDerWaalsContact O-N 3.12Å; L55-L58 PolarHBondContact O-N 2.82Å; L55-L58 VanDerWaalsContact O-N 3.15Å; L58-M62 PolarHBondContact O-N 2.85Å; L58-K63 HydrophobicContact CB-CB 4.38Å; L58-K63 HydrophobicContact CD2-CB 4.05Å; L58-K63 HydrophobicContact CD2-CG 4.19Å; L58-K63 WeakPolarHBondContact O-CB 2.85Å; L58-K63 PolarHBondContact O-N 2.76Å; L58-I64 HydrophobicContact CB-CD1 3.75Å; L58-I64 HydrophobicContact CB-CG1 4.08Å; L58-I64 HydrophobicContact CD1-CD1 4.1Å; L58-I64 PolarHBondContact O-N 3.46Å; L58-P254 HydrophobicContact CD1-CB 4.34Å; L58-Y255 HydrophobicContact CD1-CD1 3.96Å; L58-Y255 HydrophobicContact CD1-CE1 4.17Å; L58-F258 HydrophobicContact CD1-CD2 4.48Å; L58-F258 HydrophobicContact CD2-CB 3.5Å; L58-F258 VanDerWaalsContact CD2-CB 3.5Å; L58-F258 HydrophobicContact CD2-CD2 4.15Å; L58-F258 HydrophobicContact CD2-CG 4.02Å; L58-L262 HydrophobicContact CD1-CD1 4.22Å; L58-L262 HydrophobicContact CD2-CD1 4.46Å; L58-L262 HydrophobicContact CD2-CD2 4.04Å; L58-L262 HydrophobicContact CD2-CG 4.02Å; L58-L262 HydrophobicContact CG-CD1 4.46Å; L58-L262 HydrophobicContact CG-CD2 4.06Å; L58-L262 HydrophobicContact CG-CG 4.35Å
59	V	93.9	Very high	92.2	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-71.6	-49.5	176.6	173.4	0	0	0	0	110.8	W49 L55 G56 R57 D61 M62 I64 I70 I82 F85 F86	W49-V59 HydrophobicContact CH2-CB 4.24Å; W49-V59 HydrophobicContact CH2-CG1 3.99Å; W49-V59 HydrophobicContact CZ3-CG1 4.3Å; L55-V59 HydrophobicContact CD1-CG2 4.44Å; L55-V59 HydrophobicContact CG-CG2 4.5Å; L55-V59 WeakPolarHBondContact O-CG2 3.41Å; L55-V59 PolarHBondContact O-N 3.08Å; G56-V59 PolarHBondContact O-N 3.31Å; R57-V59 PolarHBondContact O-N 3.24Å; V59-D61 VanDerWaalsContact C-N 3.27Å; V59-D61 PolarHBondContact O-N 3.03Å; V59-M62 PolarHBondContact O-N 3.05Å; V59-M62 VanDerWaalsContact O-N 3.07Å; V59-I64 HydrophobicContact CG2-CB 4.33Å; V59-I64 HydrophobicContact CG2-CD1 4.3Å; V59-I70 HydrophobicContact CG2-CD1 4.16Å; V59-I82 HydrophobicContact CG1-CG2 4.34Å; V59-I82 HydrophobicContact CG2-CG2 4.06Å; V59-F85 HydrophobicContact CG1-CB 4.2Å; V59-F85 HydrophobicContact CG1-CD1 3.52Å; V59-F85 HydrophobicContact CG1-CE1 4.09Å; V59-F85 HydrophobicContact CG1-CG 3.95Å; V59-F86 HydrophobicContact CB-CE2 4.37Å; V59-F86 HydrophobicContact CB-CZ 4.48Å; V59-F86 HydrophobicContact CG1-CD2 4.39Å; V59-F86 HydrophobicContact CG1-CE2 3.58Å; V59-F86 HydrophobicContact CG1-CZ 3.77Å; V59-F86 HydrophobicContact CG2-CE2 3.84Å; V59-F86 HydrophobicContact CG2-CZ 4.08Å
60	K	91.8	Very high	92.3	Very high	66 Å²	66	57 Å²	57	29%	0.287	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-38.6	178.7	-175.8	171.7	180	176.3	0	112	E48 W49 P51 G56 R57 M62	E48-K60 IonicContact OE1-NZ 2.72Å; E48-K60 PolarHBondContact OE1-NZ 3.44Å; W49-K60 HydrophobicContact CZ3-CB 4.24Å; W49-K60 WeakPolarHBondContact O-CD 3.46Å; W49-K60 WeakPolarHBondContact O-CE 3.47Å; W49-K60 PolarHBondContact O-NZ 3.22Å; P51-K60 VanDerWaalsContact CD-CD 3.5Å; P51-K60 HydrophobicContact CG-CB 4.07Å; P51-K60 HydrophobicContact CG-CD 3.92Å; G56-K60 WeakPolarHBondContact O-CB 3.44Å; G56-K60 PolarHBondContact O-N 3.43Å; R57-K60 PolarHBondContact O-N 3.24Å; K60-M62 PolarHBondContact O-N 2.94Å
61	D	91.7	Very high	92.5	Very high	64 Å²	64	54 Å²	54	34%	0.342	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	11.8	-179.3	-58.1	-31.6	0	0	0	113	R57 V59 K63 H261	R57-D61 WeakPolarHBondContact O-CB 3.46Å; R57-D61 PolarHBondContact O-N 3.48Å; R57-D61 VanDerWaalsContact O-OD2 3.11Å; V59-D61 VanDerWaalsContact C-N 3.27Å; V59-D61 PolarHBondContact O-N 3.03Å; D61-K63 HydrophobicContact CB-CG 4.42Å; D61-K63 PolarHBondContact O-N 3.05Å; D61-H261 IonicContact OD2-CE1 3.22Å; D61-H261 PolarHBondContact OD2-CE1 2.77Å; D61-H261 IonicContact OD2-NE2 3.98Å
62	M	92.1	Very high	92.6	Very high	141 Å²	141	59.1 Å²	59.1	70%	0.695	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	30.1	177.6	-61.5	-172.8	-75	0	0	114.9	L58 V59 K60 F85	L58-M62 PolarHBondContact O-N 2.85Å; V59-M62 PolarHBondContact O-N 3.05Å; V59-M62 VanDerWaalsContact O-N 3.07Å; K60-M62 PolarHBondContact O-N 2.94Å; M62-F85 HydrophobicContact CG-CZ 4.13Å
63	K	92.3	Very high	92.7	Very high	80 Å²	80	56.8 Å²	56.8	35%	0.348	27%	0.266	S	S	.	.			trans	-80.2	-34.4	174.5	-60.8	-57.3	-178	-174	0	112.2	L58 D61 F258	L58-K63 HydrophobicContact CB-CB 4.38Å; L58-K63 HydrophobicContact CD2-CB 4.05Å; L58-K63 HydrophobicContact CD2-CG 4.19Å; L58-K63 WeakPolarHBondContact O-CB 2.85Å; L58-K63 PolarHBondContact O-N 2.76Å; D61-K63 HydrophobicContact CB-CG 4.42Å; D61-K63 PolarHBondContact O-N 3.05Å; K63-F258 HydrophobicContact CB-CD1 4.17Å; K63-F258 HydrophobicContact CB-CD2 3.95Å; K63-F258 HydrophobicContact CB-CE1 4.1Å; K63-F258 HydrophobicContact CB-CE2 3.89Å; K63-F258 HydrophobicContact CB-CG 4.1Å; K63-F258 HydrophobicContact CB-CZ 3.97Å; K63-F258 HydrophobicContact CD-CD1 4.08Å; K63-F258 HydrophobicContact CD-CE1 3.97Å; K63-F258 HydrophobicContact CG-CD1 4.23Å; K63-F258 HydrophobicContact CG-CE1 4.39Å; K63-F258 HydrophobicContact CG-CG 4.42Å; K63-F258 WeakPolarHBondContact O-CZ 3.36Å
64	I	92.6	Very high	92.8	Very high	1 Å²	1	60 Å²	60	1%	0.005	29%	0.291	C	S	.	.			trans	-98.3	120.3	172.1	-65	171.7	0	0	0	107.4	L55 L58 V59 S66 E69 I70 F86 P254	L55-I64 HydrophobicContact CD1-CD1 3.55Å; L58-I64 HydrophobicContact CB-CD1 3.75Å; L58-I64 HydrophobicContact CB-CG1 4.08Å; L58-I64 HydrophobicContact CD1-CD1 4.1Å; L58-I64 PolarHBondContact O-N 3.46Å; V59-I64 HydrophobicContact CG2-CB 4.33Å; V59-I64 HydrophobicContact CG2-CD1 4.3Å; I64-S66 WeakPolarHBondContact CG2-O 3.5Å; I64-E69 HydrophobicContact CG2-CB 4.19Å; I64-I70 HydrophobicContact CG2-CD1 4.33Å; I64-I70 HydrophobicContact CG2-CG1 4.01Å; I64-F86 HydrophobicContact CG2-CZ 4.05Å; I64-P254 HydrophobicContact CD1-CB 4.09Å; I64-P254 HydrophobicContact CG1-CB 4.2Å
65	K	89.7	Confident	92.9	Very high	176 Å²	176	56.2 Å²	56.2	77%	0.765	28%	0.275	S	S	*	.			trans	-91.2	-25.5	-172.9	-65.8	178.8	-177.1	174.9	0	112.8	E69 F86	K65-E69 PolarHBondContact N-OE2 3.02Å; K65-F86 WeakPolarHBondContact O-CE1 3.38Å
66	S	93	Very high	93	Very high	33 Å²	33	60.1 Å²	60.1	23%	0.231	30%	0.3	C	S	.	.			trans	-135.7	151	-173.9	68	0	0	0	0	112.6	I64 E68 E69	I64-S66 WeakPolarHBondContact CG2-O 3.5Å; S66-E68 PolarHBondContact O-N 2.99Å; S66-E69 PolarHBondContact N-OE1 3.46Å; S66-E69 PolarHBondContact O-N 3.39Å; S66-E69 VanDerWaalsContact OG-CG 3.32Å; S66-E69 WeakPolarHBondContact OG-CG 3.5Å; S66-E69 PolarHBondContact OG-N 3.18Å; S66-E69 PolarHBondContact OG-OE1 3.31Å
67	L	92.8	Very high	93.1	Very high	10 Å²	10	61.2 Å²	61.2	5%	0.052	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-24	170.2	-172.5	59.3	0	0	0	111.7	E69 I70 Y71 I77 I83 F86 L87	L67-E69 PolarHBondContact O-N 2.89Å; L67-I70 HydrophobicContact CD1-CB 4.37Å; L67-I70 HydrophobicContact CD1-CD1 4.01Å; L67-I70 WeakPolarHBondContact O-CB 3.29Å; L67-I70 PolarHBondContact O-N 3.07Å; L67-I70 VanDerWaalsContact O-N 3.15Å; L67-Y71 HydrophobicContact CB-CE2 4.47Å; L67-Y71 HydrophobicContact CD2-CE2 3.92Å; L67-Y71 VanDerWaalsContact CD2-OH 3.24Å; L67-Y71 WeakPolarHBondContact CD2-OH 3.44Å; L67-Y71 HydrophobicContact CG-CD2 4.35Å; L67-Y71 HydrophobicContact CG-CE1 4.39Å; L67-Y71 HydrophobicContact CG-CE2 3.61Å; L67-Y71 WeakPolarHBondContact O-CD2 3.44Å; L67-Y71 PolarHBondContact O-N 3.5Å; L67-Y71 VanDerWaalsContact O-N 3.16Å; L67-I77 HydrophobicContact CD1-CD1 3.94Å; L67-I83 HydrophobicContact CD1-CD1 3.59Å; L67-I83 HydrophobicContact CD2-CD1 3.94Å; L67-I83 HydrophobicContact CG-CD1 4.44Å; L67-F86 HydrophobicContact CB-CB 4.37Å; L67-F86 HydrophobicContact CB-CD2 4.24Å; L67-F86 HydrophobicContact CB-CG 4.26Å; L67-F86 HydrophobicContact CD1-CD2 4.22Å; L67-L87 HydrophobicContact CD2-CD1 3.61Å; L67-L87 HydrophobicContact CD2-CG 4.17Å
68	E	92.6	Very high	93.2	Very high	140 Å²	140	66.1 Å²	66.1	65%	0.654	33%	0.329	S	S	*	.	H	α-helix	trans	-64.6	-37.4	177.3	-61.5	179.3	174.9	0	0	112.3	S66 I70 Y71 L72	S66-E68 PolarHBondContact O-N 2.99Å; E68-I70 VanDerWaalsContact C-N 3.26Å; E68-I70 PolarHBondContact O-N 3.11Å; E68-Y71 PolarHBondContact O-N 3.38Å; E68-L72 WeakPolarHBondContact O-CB 3.47Å; E68-L72 PolarHBondContact O-N 2.75Å
69	E	92.7	Very high	93.3	Very high	60 Å²	60	66.8 Å²	66.8	28%	0.28	33%	0.332	S	S	.	.	H	α-helix	trans	-59.1	-38.9	172.4	-74.4	160.7	-133.7	0	0	111.5	I64 K65 S66 L67 Y71 L72 Y73	I64-E69 HydrophobicContact CG2-CB 4.19Å; K65-E69 PolarHBondContact N-OE2 3.02Å; S66-E69 PolarHBondContact N-OE1 3.46Å; S66-E69 PolarHBondContact O-N 3.39Å; S66-E69 VanDerWaalsContact OG-CG 3.32Å; S66-E69 WeakPolarHBondContact OG-CG 3.5Å; S66-E69 PolarHBondContact OG-N 3.18Å; S66-E69 PolarHBondContact OG-OE1 3.31Å; L67-E69 PolarHBondContact O-N 2.89Å; E69-Y71 VanDerWaalsContact C-N 3.35Å; E69-L72 PolarHBondContact O-N 2.96Å; E69-Y73 VanDerWaalsContact O-CD2 3.3Å; E69-Y73 WeakPolarHBondContact O-CD2 3.32Å; E69-Y73 PolarHBondContact O-N 3.27Å
70	I	94.7	Very high	93.3	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-65.5	-41.8	177.8	-60.5	-179.8	0	0	0	110.2	L55 V59 I64 L67 E68 S74 L75 I77 I82 F86	L55-I70 HydrophobicContact CD1-CD1 4.12Å; L55-I70 HydrophobicContact CD1-CG1 4.2Å; L55-I70 HydrophobicContact CD2-CD1 4.44Å; L55-I70 HydrophobicContact CD2-CG2 4.3Å; V59-I70 HydrophobicContact CG2-CD1 4.16Å; I64-I70 HydrophobicContact CG2-CD1 4.33Å; I64-I70 HydrophobicContact CG2-CG1 4.01Å; L67-I70 HydrophobicContact CD1-CB 4.37Å; L67-I70 HydrophobicContact CD1-CD1 4.01Å; L67-I70 WeakPolarHBondContact O-CB 3.29Å; L67-I70 PolarHBondContact O-N 3.07Å; L67-I70 VanDerWaalsContact O-N 3.15Å; E68-I70 VanDerWaalsContact C-N 3.26Å; E68-I70 PolarHBondContact O-N 3.11Å; I70-S74 PolarHBondContact O-N 3.32Å; I70-L75 HydrophobicContact CG2-CB 4.02Å; I70-L75 PolarHBondContact O-N 2.88Å; I70-I77 HydrophobicContact CG2-CD1 4.02Å; I70-I77 HydrophobicContact CG2-CG1 3.88Å; I70-I82 HydrophobicContact CD1-CG2 4Å; I70-F86 HydrophobicContact CD1-CE2 3.88Å
71	Y	94.3	Very high	93.4	Very high	47 Å²	47	68 Å²	68	18%	0.184	34%	0.34	C	S	.	.	H	α-helix	trans	-68	-40.8	177.3	-62.4	-40.9	0	0	0	112.9	L67 E68 E69 Y73 S74 H125 I151 P153	L67-Y71 HydrophobicContact CB-CE2 4.47Å; L67-Y71 HydrophobicContact CD2-CE2 3.92Å; L67-Y71 VanDerWaalsContact CD2-OH 3.24Å; L67-Y71 WeakPolarHBondContact CD2-OH 3.44Å; L67-Y71 HydrophobicContact CG-CD2 4.35Å; L67-Y71 HydrophobicContact CG-CE1 4.39Å; L67-Y71 HydrophobicContact CG-CE2 3.61Å; L67-Y71 WeakPolarHBondContact O-CD2 3.44Å; L67-Y71 PolarHBondContact O-N 3.5Å; L67-Y71 VanDerWaalsContact O-N 3.16Å; E68-Y71 PolarHBondContact O-N 3.38Å; E69-Y71 VanDerWaalsContact C-N 3.35Å; Y71-Y73 VanDerWaalsContact C-N 3.28Å; Y71-Y73 PolarHBondContact O-N 3.43Å; Y71-S74 PolarHBondContact O-N 3.12Å; Y71-H125 AromaticContact CE2-CD2 3.9Å; Y71-H125 AromaticContact CE2-NE2 3.82Å; Y71-I151 WeakPolarHBondContact OH-CG2 3.44Å; Y71-P153 HydrophobicContact CD1-CG 4.35Å; Y71-P153 HydrophobicContact CD2-CB 3.92Å; Y71-P153 HydrophobicContact CD2-CG 3.69Å; Y71-P153 HydrophobicContact CE2-CB 3.83Å; Y71-P153 HydrophobicContact CE2-CG 3.9Å; Y71-P153 HydrophobicContact CG-CG 3.94Å
72	L	93.8	Very high	93.6	Very high	122 Å²	122	65 Å²	65	64%	0.639	32%	0.324	S	S	*	.	H	α-helix	trans	-56.1	-43.8	180	-177.5	66.2	0	0	0	111.7	E68 E69 S74	E68-L72 WeakPolarHBondContact O-CB 3.47Å; E68-L72 PolarHBondContact O-N 2.75Å; E69-L72 PolarHBondContact O-N 2.96Å; L72-S74 VanDerWaalsContact C-N 3.33Å
73	Y	94.1	Very high	93.7	Very high	60 Å²	60	58.3 Å²	58.3	24%	0.235	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	6.5	178	-66.1	-73.6	0	0	0	114	E69 Y71 L75 T251 K252 P254	E69-Y73 VanDerWaalsContact O-CD2 3.3Å; E69-Y73 WeakPolarHBondContact O-CD2 3.32Å; E69-Y73 PolarHBondContact O-N 3.27Å; Y71-Y73 VanDerWaalsContact C-N 3.28Å; Y71-Y73 PolarHBondContact O-N 3.43Å; Y73-L75 PolarHBondContact O-N 3.15Å; Y73-T251 VanDerWaalsContact OH-CB 3.31Å; Y73-T251 WeakPolarHBondContact OH-CB 3.27Å; Y73-T251 PolarHBondContact OH-O 3.36Å; Y73-T251 PolarHBondContact OH-OG1 2.87Å; Y73-K252 PolarHBondContact OH-N 2.97Å; Y73-K252 PolarHBondContact OH-O 2.79Å; Y73-P254 HydrophobicContact CD2-CG 3.9Å; Y73-P254 HydrophobicContact CE2-CG 4.11Å
74	S	93.8	Very high	93.7	Very high	104 Å²	104	57.2 Å²	57.2	73%	0.727	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	39.8	179.6	-61.4	0	0	0	0	113.2	I70 Y71 L72	I70-S74 PolarHBondContact O-N 3.32Å; Y71-S74 PolarHBondContact O-N 3.12Å; L72-S74 VanDerWaalsContact C-N 3.33Å
75	L	93.9	Very high	93.7	Very high	23 Å²	23	61.8 Å²	61.8	12%	0.12	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-76.4	132.1	-176.5	-59.5	-178.1	0	0	0	110.8	L55 I70 Y73 I77 Y255	L55-L75 HydrophobicContact CD1-CD1 3.95Å; L55-L75 HydrophobicContact CD2-CB 4.41Å; I70-L75 HydrophobicContact CG2-CB 4.02Å; I70-L75 PolarHBondContact O-N 2.88Å; Y73-L75 PolarHBondContact O-N 3.15Å; L75-I77 PolarHBondContact O-N 3.25Å; L75-Y255 HydrophobicContact CD1-CE2 4.23Å; L75-Y255 HydrophobicContact CD2-CD2 4.15Å; L75-Y255 HydrophobicContact CD2-CE2 3.57Å; L75-Y255 HydrophobicContact CG-CE2 4.49Å
76	P	95	Very high	93.9	Very high	85 Å²	85	55.6 Å²	55.6	55%	0.552	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-74.7	119.5	-177.8	28.5	-34	0	0	0	111.6
77	I	95.4	Very high	93.8	Very high	24 Å²	24	55 Å²	55	12%	0.123	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-80.2	120.2	174.9	-52.9	179.8	0	0	0	109	L55 L67 I70 L75 E79 I82 I83 L149	L55-I77 HydrophobicContact CD2-CG1 4.47Å; L67-I77 HydrophobicContact CD1-CD1 3.94Å; I70-I77 HydrophobicContact CG2-CD1 4.02Å; I70-I77 HydrophobicContact CG2-CG1 3.88Å; L75-I77 PolarHBondContact O-N 3.25Å; I77-E79 WeakPolarHBondContact CG2-O 3.31Å; I77-I82 HydrophobicContact CG2-CB 4.26Å; I77-I82 HydrophobicContact CG2-CD1 4.27Å; I77-I82 HydrophobicContact CG2-CG2 4.4Å; I77-I83 HydrophobicContact CD1-CD1 3.56Å; I77-I83 HydrophobicContact CD1-CG1 4.36Å; I77-I83 HydrophobicContact CG2-CD1 4.46Å; I77-I83 HydrophobicContact CG2-CG1 4.22Å; I77-L149 HydrophobicContact CG2-CD2 4.11Å
78	K	94.7	Very high	93.3	Very high	151 Å²	151	56.2 Å²	56.2	66%	0.657	29%	0.291	S	S	*	.			trans	-118.5	-8.5	-178.5	-65.1	-175.7	180	179.7	0	114	T53 L149	T53-K78 HydrophobicContact CG2-CB 4.39Å; K78-L149 VanDerWaalsContact C-CD2 3.45Å
79	E	94.3	Very high	93.1	Very high	15 Å²	15	55.9 Å²	55.9	7%	0.07	30%	0.304	C	S	.	.			trans	-119.1	124.7	178.5	-63.3	176.2	-151.6	0	0	107.3	W49 P51 V52 T53 I77 E81 I82 L149	W49-E79 WeakPolarHBondContact CZ2-OE2 3.3Å; W49-E79 PolarHBondContact NE1-OE2 3.32Å; P51-E79 WeakPolarHBondContact CA-OE2 3.04Å; V52-E79 HydrophobicContact CG2-CG 4.5Å; V52-E79 VanDerWaalsContact CG2-OE1 3.29Å; V52-E79 WeakPolarHBondContact CG2-OE1 3.38Å; V52-E79 PolarHBondContact N-OE1 2.85Å; T53-E79 WeakPolarHBondContact CB-OE1 3.47Å; T53-E79 HydrophobicContact CG2-CG 4.33Å; T53-E79 WeakPolarHBondContact CG2-OE1 3.47Å; T53-E79 PolarHBondContact N-OE1 2.89Å; T53-E79 PolarHBondContact OG1-OE1 2.77Å; I77-E79 WeakPolarHBondContact CG2-O 3.31Å; E79-E81 PolarHBondContact O-N 3.31Å; E79-I82 HydrophobicContact CB-CD1 3.91Å; E79-I82 HydrophobicContact CB-CG1 4.06Å; E79-I82 PolarHBondContact O-N 3.37Å; E79-L149 VanDerWaalsContact C-CD2 3.48Å
80	S	94.4	Very high	93.1	Very high	13 Å²	13	55.2 Å²	55.2	9%	0.091	31%	0.306	C	S	.	.	H	α-helix	trans	-69.6	-25.4	-179.4	42.6	0	0	0	0	112.1	I82 I83 D84	S80-I82 PolarHBondContact O-N 3.19Å; S80-I83 WeakPolarHBondContact O-CB 3.47Å; S80-I83 PolarHBondContact O-N 3.46Å; S80-D84 PolarHBondContact O-N 3.06Å; S80-D84 VanDerWaalsContact O-N 3.16Å
81	E	94.6	Very high	93	Very high	79 Å²	79	56.5 Å²	56.5	37%	0.369	31%	0.313	S	S	.	.	H	α-helix	trans	-63	-27.5	179.3	-62.1	86	164.9	0	0	111.7	W49 E79 I83 D84 F85	W49-E81 HydrophobicContact CB-CB 4.4Å; W49-E81 HydrophobicContact CB-CG 4.35Å; W49-E81 HydrophobicContact CD2-CB 3.45Å; W49-E81 VanDerWaalsContact CD2-CB 3.45Å; W49-E81 HydrophobicContact CD2-CG 4.26Å; W49-E81 VanDerWaalsContact CE2-CB 3.44Å; W49-E81 HydrophobicContact CE3-CB 4.02Å; W49-E81 HydrophobicContact CG-CB 3.6Å; W49-E81 HydrophobicContact CG-CG 3.85Å; W49-E81 HydrophobicContact CZ2-CB 4.02Å; E79-E81 PolarHBondContact O-N 3.31Å; E81-I83 VanDerWaalsContact C-N 3.29Å; E81-I83 PolarHBondContact O-N 2.96Å; E81-D84 PolarHBondContact O-N 3.18Å; E81-F85 WeakPolarHBondContact O-CB 3.32Å; E81-F85 PolarHBondContact O-N 2.62Å
82	I	94.5	Very high	93.1	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-43.3	171.9	-66.8	168.4	0	0	0	110.5	W49 L55 V59 I70 I77 E79 S80 F85 F86	W49-I82 HydrophobicContact CH2-CB 4.41Å; W49-I82 HydrophobicContact CH2-CG1 3.7Å; W49-I82 HydrophobicContact CZ2-CG1 3.64Å; L55-I82 HydrophobicContact CB-CD1 4.45Å; L55-I82 HydrophobicContact CD2-CD1 3.98Å; L55-I82 HydrophobicContact CG-CD1 4.01Å; V59-I82 HydrophobicContact CG1-CG2 4.34Å; V59-I82 HydrophobicContact CG2-CG2 4.06Å; I70-I82 HydrophobicContact CD1-CG2 4Å; I77-I82 HydrophobicContact CG2-CB 4.26Å; I77-I82 HydrophobicContact CG2-CD1 4.27Å; I77-I82 HydrophobicContact CG2-CG2 4.4Å; E79-I82 HydrophobicContact CB-CD1 3.91Å; E79-I82 HydrophobicContact CB-CG1 4.06Å; E79-I82 PolarHBondContact O-N 3.37Å; S80-I82 PolarHBondContact O-N 3.19Å; I82-F85 PolarHBondContact O-N 2.77Å; I82-F86 HydrophobicContact CG2-CD2 4.26Å; I82-F86 HydrophobicContact CG2-CE2 4.1Å; I82-F86 WeakPolarHBondContact O-CD2 3.33Å; I82-F86 PolarHBondContact O-N 3.46Å
83	I	94.5	Very high	93.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-72.5	-36.8	179.7	-63.9	-55.9	0	0	0	110.8	L67 I77 S80 E81 F85 F86 L87 L91 K148 I151	L67-I83 HydrophobicContact CD1-CD1 3.59Å; L67-I83 HydrophobicContact CD2-CD1 3.94Å; L67-I83 HydrophobicContact CG-CD1 4.44Å; I77-I83 HydrophobicContact CD1-CD1 3.56Å; I77-I83 HydrophobicContact CD1-CG1 4.36Å; I77-I83 HydrophobicContact CG2-CD1 4.46Å; I77-I83 HydrophobicContact CG2-CG1 4.22Å; S80-I83 WeakPolarHBondContact O-CB 3.47Å; S80-I83 PolarHBondContact O-N 3.46Å; E81-I83 VanDerWaalsContact C-N 3.29Å; E81-I83 PolarHBondContact O-N 2.96Å; I83-F85 VanDerWaalsContact C-N 3.29Å; I83-F85 PolarHBondContact O-N 3.03Å; I83-F86 PolarHBondContact O-N 3.43Å; I83-L87 PolarHBondContact O-N 2.86Å; I83-L91 HydrophobicContact CG2-CD1 3.6Å; I83-K148 HydrophobicContact CB-CB 4.26Å; I83-K148 WeakPolarHBondContact CG1-O 3.21Å; I83-K148 HydrophobicContact CG2-CB 4.21Å; I83-K148 HydrophobicContact CG2-CG 4.38Å; I83-I151 HydrophobicContact CD1-CG2 3.49Å; I83-I151 VanDerWaalsContact CD1-CG2 3.49Å; I83-I151 HydrophobicContact CG1-CG2 3.95Å; I83-I151 HydrophobicContact CG2-CD1 4.31Å; I83-I151 HydrophobicContact CG2-CG2 4.34Å
84	D	93.3	Very high	93.2	Very high	57 Å²	57	58.4 Å²	58.4	31%	0.305	32%	0.323	S	S	.	.	H	α-helix	trans	-65.6	-33.9	175.8	-67.5	-26.4	0	0	0	112.2	S80 E81 G88 K148	S80-D84 PolarHBondContact O-N 3.06Å; S80-D84 VanDerWaalsContact O-N 3.16Å; E81-D84 PolarHBondContact O-N 3.18Å; D84-G88 WeakPolarHBondContact O-CA 3.49Å; D84-G88 PolarHBondContact O-N 3.13Å; D84-K148 WeakPolarHBondContact OD1-CD 3.21Å; D84-K148 WeakPolarHBondContact OD1-CE 3.29Å; D84-K148 IonicContact OD1-NZ 3.73Å; D84-K148 PolarHBondContact OD1-NZ 2.81Å; D84-K148 IonicContact OD2-NZ 3.12Å; D84-K148 PolarHBondContact OD2-NZ 2.72Å
85	F	92.7	Very high	93.3	Very high	97 Å²	97	56 Å²	56	43%	0.425	30%	0.304	S	S	.	.	H	α-helix	trans	-62.4	-42.5	174.5	-176.3	-94.8	0	0	0	112.5	W49 V59 M62 E81 I82 I83	W49-F85 HydrophobicContact CZ3-CB 4.12Å; W49-F85 HydrophobicContact CZ3-CD2 4.42Å; W49-F85 HydrophobicContact CZ3-CG 4.42Å; V59-F85 HydrophobicContact CG1-CB 4.2Å; V59-F85 HydrophobicContact CG1-CD1 3.52Å; V59-F85 HydrophobicContact CG1-CE1 4.09Å; V59-F85 HydrophobicContact CG1-CG 3.95Å; M62-F85 HydrophobicContact CG-CZ 4.13Å; E81-F85 WeakPolarHBondContact O-CB 3.32Å; E81-F85 PolarHBondContact O-N 2.62Å; I82-F85 PolarHBondContact O-N 2.77Å; I83-F85 VanDerWaalsContact C-N 3.29Å; I83-F85 PolarHBondContact O-N 3.03Å
86	F	92.6	Very high	93.4	Very high	47 Å²	47	56 Å²	56	21%	0.206	30%	0.304	C	S	.	.	H	α-helix	trans	-86.2	-41.6	-177.9	-70.1	-63.6	0	0	0	114	V59 I64 K65 L67 I70 I82 I83	V59-F86 HydrophobicContact CB-CE2 4.37Å; V59-F86 HydrophobicContact CB-CZ 4.48Å; V59-F86 HydrophobicContact CG1-CD2 4.39Å; V59-F86 HydrophobicContact CG1-CE2 3.58Å; V59-F86 HydrophobicContact CG1-CZ 3.77Å; V59-F86 HydrophobicContact CG2-CE2 3.84Å; V59-F86 HydrophobicContact CG2-CZ 4.08Å; I64-F86 HydrophobicContact CG2-CZ 4.05Å; K65-F86 WeakPolarHBondContact O-CE1 3.38Å; L67-F86 HydrophobicContact CB-CB 4.37Å; L67-F86 HydrophobicContact CB-CD2 4.24Å; L67-F86 HydrophobicContact CB-CG 4.26Å; L67-F86 HydrophobicContact CD1-CD2 4.22Å; I70-F86 HydrophobicContact CD1-CE2 3.88Å; I82-F86 HydrophobicContact CG2-CD2 4.26Å; I82-F86 HydrophobicContact CG2-CE2 4.1Å; I82-F86 WeakPolarHBondContact O-CD2 3.33Å; I82-F86 PolarHBondContact O-N 3.46Å; I83-F86 PolarHBondContact O-N 3.43Å
87	L	90.5	Very high	93.3	Very high	21 Å²	21	56.1 Å²	56.1	11%	0.11	30%	0.296	C	S	.	.	H	α-helix	trans	-119.4	-0.6	-168.7	-61.7	177.8	0	0	0	113.5	L67 I83 S89 S90 L91 H125 I151	L67-L87 HydrophobicContact CD2-CD1 3.61Å; L67-L87 HydrophobicContact CD2-CG 4.17Å; I83-L87 PolarHBondContact O-N 2.86Å; L87-S89 VanDerWaalsContact C-N 3.31Å; L87-S89 PolarHBondContact O-N 3.28Å; L87-S90 PolarHBondContact O-N 3.49Å; L87-S90 PolarHBondContact O-OG 3.45Å; L87-L91 HydrophobicContact CB-CD1 3.93Å; L87-L91 HydrophobicContact CB-CD2 4Å; L87-L91 HydrophobicContact CB-CG 3.72Å; L87-L91 HydrophobicContact CD1-CD2 4.2Å; L87-L91 WeakPolarHBondContact O-CG 3.36Å; L87-L91 PolarHBondContact O-N 3.41Å; L87-L91 VanDerWaalsContact O-N 3.13Å; L87-H125 HydrophobicContact CD1-CB 4.14Å; L87-I151 HydrophobicContact CD1-CD1 3.95Å
88	G	83.4	Confident	93.3	Very high	35 Å²	35	58.3 Å²	58.3	36%	0.361	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-38.4	-164.3	0	0	0	0	0	116.2	D84	D84-G88 WeakPolarHBondContact O-CA 3.49Å; D84-G88 PolarHBondContact O-N 3.13Å
89	S	88.1	Confident	93.3	Very high	132 Å²	132	54.2 Å²	54.2	92%	0.923	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-22.2	178.5	56.6	0	0	0	0	114.3	L87	L87-S89 VanDerWaalsContact C-N 3.31Å; L87-S89 PolarHBondContact O-N 3.28Å
90	S	92.4	Very high	93.4	Very high	47 Å²	47	57.5 Å²	57.5	33%	0.329	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-21.8	-174.4	66.8	0	0	0	0	113.5	L87 K92	L87-S90 PolarHBondContact O-N 3.49Å; L87-S90 PolarHBondContact O-OG 3.45Å; S90-K92 PolarHBondContact O-N 3.15Å
91	L	93.6	Very high	93.5	Very high	27 Å²	27	59.3 Å²	59.3	14%	0.141	32%	0.324	C	S	.	.			trans	-71.4	126.3	-176.6	-68.6	178.8	0	0	0	111.5	I83 L87 I119 D121 I151	I83-L91 HydrophobicContact CG2-CD1 3.6Å; L87-L91 HydrophobicContact CB-CD1 3.93Å; L87-L91 HydrophobicContact CB-CD2 4Å; L87-L91 HydrophobicContact CB-CG 3.72Å; L87-L91 HydrophobicContact CD1-CD2 4.2Å; L87-L91 WeakPolarHBondContact O-CG 3.36Å; L87-L91 PolarHBondContact O-N 3.41Å; L87-L91 VanDerWaalsContact O-N 3.13Å; L91-I119 HydrophobicContact CB-CG2 4.16Å; L91-I119 HydrophobicContact CD1-CG2 4.19Å; L91-I119 HydrophobicContact CD2-CG2 3.77Å; L91-I119 HydrophobicContact CG-CG2 4.25Å; L91-D121 HydrophobicContact CD2-CB 4.17Å; L91-I151 HydrophobicContact CD2-CD1 3.86Å
92	K	95.4	Very high	93.6	Very high	121 Å²	121	61 Å²	61	53%	0.526	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.9	165.7	-55.1	-164.2	-166.5	169	0	109.6	S90 I119 G120 Y122	S90-K92 PolarHBondContact O-N 3.15Å; K92-I119 WeakPolarHBondContact O-CA 3.5Å; K92-G120 PolarHBondContact N-O 3.46Å; K92-G120 PolarHBondContact O-N 3.46Å; K92-G120 VanDerWaalsContact O-N 3.09Å; K92-Y122 HydrophobicContact CB-CE2 4.02Å; K92-Y122 HydrophobicContact CD-CE2 3.62Å; K92-Y122 HydrophobicContact CG-CE2 3.88Å
93	D	94.8	Very high	93.7	Very high	89 Å²	89	67.9 Å²	67.9	48%	0.476	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	144	172.4	65.3	-71.1	0	0	0	111.5	V117 A118 I119 I144	D93-V117 HydrophobicContact CB-CG1 4.22Å; D93-A118 WeakPolarHBondContact CA-O 3.46Å; D93-I119 HydrophobicContact CB-CD1 4.37Å; D93-I119 HydrophobicContact CB-CG1 3.85Å; D93-I144 HydrophobicContact CB-CG1 4.36Å
94	E	95.6	Very high	93.8	Very high	60 Å²	60	74 Å²	74	28%	0.28	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	127.2	173	-170.3	177.7	-177.8	0	0	110.5	L96 V117 A118 K201 M205	E94-L96 PolarHBondContact O-N 2.99Å; E94-V117 WeakPolarHBondContact O-CA 3.19Å; E94-A118 PolarHBondContact N-O 3.42Å; E94-A118 PolarHBondContact O-N 3.32Å; E94-K201 WeakPolarHBondContact OE1-CD 3.41Å; E94-K201 WeakPolarHBondContact OE1-CE 3.42Å; E94-K201 IonicContact OE1-NZ 3.76Å; E94-K201 PolarHBondContact OE1-NZ 3.4Å; E94-M205 HydrophobicContact CB-CE 3.2Å; E94-M205 HydrophobicContact CG-CE 4.4Å
95	V	96.2	Very high	94	Very high	53 Å²	53	74 Å²	74	32%	0.321	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.4	175.7	-173.6	0	0	0	0	109	I98 V117 I140	V95-I98 HydrophobicContact CG1-CD1 4.25Å; V95-I98 HydrophobicContact CG1-CG1 3.96Å; V95-V117 HydrophobicContact CG2-CG2 4.21Å; V95-I140 HydrophobicContact CG2-CG2 4.09Å
96	L	94.4	Very high	94.1	Very high	23 Å²	23	82.2 Å²	82.2	12%	0.12	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	-50.6	-178.1	-63.8	177.5	0	0	0	112	E94 F116 A118 L128 K201 L222 A226	E94-L96 PolarHBondContact O-N 2.99Å; L96-F116 HydrophobicContact CB-CB 4.21Å; L96-F116 PolarHBondContact N-O 3.45Å; L96-A118 HydrophobicContact CD1-CB 4.17Å; L96-A118 HydrophobicContact CD2-CB 4.33Å; L96-A118 HydrophobicContact CG-CB 4.2Å; L96-L128 HydrophobicContact CD1-CD1 3.98Å; L96-K201 HydrophobicContact CD2-CB 4.25Å; L96-K201 HydrophobicContact CD2-CD 3.96Å; L96-L222 HydrophobicContact CB-CD2 4.29Å; L96-A226 HydrophobicContact CD1-CB 4.08Å
97	K	93.5	Very high	94.3	Very high	88 Å²	88	84.8 Å²	84.8	38%	0.383	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	144.1	179.9	-173.2	164.4	175.2	170	0	111.2	M99 F116 L222	K97-M99 HydrophobicContact CD-CG 4.02Å; K97-M99 HydrophobicContact CD-SD 4.27Å; K97-M99 HydrophobicContact CG-CG 3.85Å; K97-F116 PolarHBondContact O-N 2.97Å; K97-L222 HydrophobicContact CB-CD1 3.82Å; K97-L222 HydrophobicContact CB-CD2 3.78Å; K97-L222 HydrophobicContact CB-CG 4.39Å; K97-L222 HydrophobicContact CD-CB 4.08Å; K97-L222 HydrophobicContact CD-CD1 3.71Å; K97-L222 HydrophobicContact CD-CD2 4.43Å; K97-L222 HydrophobicContact CD-CG 4.29Å; K97-L222 HydrophobicContact CG-CD1 4.38Å
98	I	95.7	Very high	94.5	Very high	70 Å²	70	85.2 Å²	85.2	36%	0.359	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	130.2	168.3	-59.4	161	0	0	0	107.3	V95 F113 K114 V136 I140	V95-I98 HydrophobicContact CG1-CD1 4.25Å; V95-I98 HydrophobicContact CG1-CG1 3.96Å; I98-F113 HydrophobicContact CG2-CB 4.32Å; I98-F113 HydrophobicContact CG2-CD1 4.34Å; I98-K114 CarbonylContact C-O 3.58Å; I98-K114 WeakPolarHBondContact CA-O 3.49Å; I98-V136 HydrophobicContact CD1-CG1 3.76Å; I98-V136 HydrophobicContact CG2-CG1 4.33Å; I98-I140 HydrophobicContact CD1-CD1 4.13Å
99	M	94.5	Very high	95.1	Very high	65 Å²	65	89.6 Å²	89.6	32%	0.32	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124.4	-179.5	-62.6	-175.3	65.6	0	0	110	K97 K114 F116	K97-M99 HydrophobicContact CD-CG 4.02Å; K97-M99 HydrophobicContact CD-SD 4.27Å; K97-M99 HydrophobicContact CG-CG 3.85Å; M99-K114 PolarHBondContact N-O 3.15Å; M99-K114 PolarHBondContact O-N 3.37Å; M99-F116 HydrophobicContact CG-CE2 4.42Å; M99-F116 HydrophobicContact SD-CE2 3.89Å
100	P	96.4	Very high	95.4	Very high	84 Å²	84	89.7 Å²	89.7	55%	0.545	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	131.5	167	29.8	-32	0	0	0	108.9	F113	P100-F113 HydrophobicContact CB-CD1 4.28Å; P100-F113 HydrophobicContact CB-CE1 4.17Å
101	V	96.2	Very high	95.6	Very high	51 Å²	51	90.6 Å²	90.6	31%	0.309	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133	173.6	-66	0	0	0	0	108.4	R112 K114	V101-R112 HydrophobicContact CG2-CB 4.02Å; V101-R112 WeakPolarHBondContact CG2-O 3.42Å; V101-R112 PolarHBondContact N-O 3.04Å; V101-R112 PolarHBondContact O-N 3.39Å; V101-R112 VanDerWaalsContact O-O 3.1Å; V101-K114 HydrophobicContact CG1-CB 4.33Å
102	Q	96.3	Very high	95.7	Very high	113 Å²	113	95 Å²	95	53%	0.528	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.5	-171.1	-49.9	-173.4	-9.2	0	0	110.2	T111	Q102-T111 HydrophobicContact CG-CG2 3.82Å
103	K	96.6	Very high	95.8	Very high	146 Å²	146	92 Å²	92	64%	0.635	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.6	170.5	176.6	177.8	177	177.5	0	108.7	R110	K103-R110 PolarHBondContact N-O 3.38Å; K103-R110 PolarHBondContact O-N 3.2Å
104	Q	97.4	Very high	95.9	Very high	129 Å²	129	91 Å²	91	60%	0.603	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	133.5	171.9	-168.7	65.2	5.1	0	0	110.2
105	T	96.8	Very high	96	Very high	56 Å²	56	88.1 Å²	88.1	34%	0.344	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	171.7	173.9	72.3	0	0	0	0	110	A107 G108 R110	T105-A107 PolarHBondContact O-N 2.87Å; T105-A107 PolarHBondContact OG1-N 3.17Å; T105-G108 WeakPolarHBondContact CA-O 3.36Å; T105-G108 WeakPolarHBondContact CB-O 3.34Å; T105-G108 PolarHBondContact N-O 3.31Å; T105-G108 PolarHBondContact O-N 3.16Å; T105-G108 PolarHBondContact OG1-O 3.46Å; T105-R110 HydrophobicContact CG2-CB 4.01Å
106	R	96.1	Very high	96.1	Very high	270 Å²	270	85.8 Å²	85.8	100%	1.019	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.1	175.9	-65.7	-177.1	179	-178.7	-1.5	112.6
107	A	95.6	Very high	96.2	Very high	100 Å²	100	84.7 Å²	84.7	83%	0.826	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	36.3	178.8	0	0	0	0	0	112.2	T105	T105-A107 PolarHBondContact O-N 2.87Å; T105-A107 PolarHBondContact OG1-N 3.17Å
108	G	95.3	Very high	96.4	Very high	30 Å²	30	80.5 Å²	80.5	31%	0.309	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	89.4	-161.8	179	0	0	0	0	0	114.6	T105	T105-G108 WeakPolarHBondContact CA-O 3.36Å; T105-G108 WeakPolarHBondContact CB-O 3.34Å; T105-G108 PolarHBondContact N-O 3.31Å; T105-G108 PolarHBondContact O-N 3.16Å; T105-G108 PolarHBondContact OG1-O 3.46Å
109	Q	95.3	Very high	96.4	Very high	127 Å²	127	77.3 Å²	77.3	59%	0.593	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	130.2	-174.2	-70.3	175.1	-9	0	0	111.9
110	R	95.3	Very high	96.5	Very high	135 Å²	135	74.2 Å²	74.2	51%	0.509	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111.7	170.2	-177.4	171	173	171.6	-7.3	110.1	K103 T105 K134	K103-R110 PolarHBondContact N-O 3.38Å; K103-R110 PolarHBondContact O-N 3.2Å; T105-R110 HydrophobicContact CG2-CB 4.01Å; R110-K134 VanDerWaalsContact NH2-CE 3.34Å
111	T	95.8	Very high	96.4	Very high	66 Å²	66	71.1 Å²	71.1	41%	0.405	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	149.3	-178.8	66.5	0	0	0	0	111.7	Q102	Q102-T111 HydrophobicContact CG-CG2 3.82Å
112	R	97.4	Very high	96.3	Very high	118 Å²	118	73.2 Å²	73.2	45%	0.445	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	162.9	168.3	-69.7	-169.3	-70.1	178.5	-2	108.3	V101 C132 S133	V101-R112 HydrophobicContact CG2-CB 4.02Å; V101-R112 WeakPolarHBondContact CG2-O 3.42Å; V101-R112 PolarHBondContact N-O 3.04Å; V101-R112 PolarHBondContact O-N 3.39Å; V101-R112 VanDerWaalsContact O-O 3.1Å; R112-C132 VanDerWaalsContact CB-SG 3.55Å; R112-S133 WeakPolarHBondContact CA-O 3.42Å; R112-S133 WeakPolarHBondContact CB-O 3.06Å
113	F	97.4	Very high	96.1	Very high	60 Å²	60	72.5 Å²	72.5	26%	0.263	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.8	177.2	-60.4	-80.3	0	0	0	109.8	I98 P100 C132 S133 K134 V136	I98-F113 HydrophobicContact CG2-CB 4.32Å; I98-F113 HydrophobicContact CG2-CD1 4.34Å; P100-F113 HydrophobicContact CB-CD1 4.28Å; P100-F113 HydrophobicContact CB-CE1 4.17Å; F113-C132 CarbonylContact O-C 3.55Å; F113-C132 VanDerWaalsContact O-CA 3.24Å; F113-C132 WeakPolarHBondContact O-CA 3.04Å; F113-S133 PolarHBondContact N-O 3.38Å; F113-S133 PolarHBondContact O-N 3.41Å; F113-K134 WeakPolarHBondContact CD2-O 3.34Å; F113-V136 HydrophobicContact CB-CG2 3.98Å; F113-V136 HydrophobicContact CD1-CG2 3.84Å; F113-V136 HydrophobicContact CD2-CG2 3.65Å; F113-V136 HydrophobicContact CE1-CG2 4.23Å; F113-V136 HydrophobicContact CE2-CG2 4.06Å; F113-V136 HydrophobicContact CG-CG2 3.52Å; F113-V136 HydrophobicContact CZ-CG2 4.32Å
114	K	97.2	Very high	95.9	Very high	67 Å²	67	65.9 Å²	65.9	29%	0.291	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.3	173	-173.6	177.8	-177.4	179.7	0	108.5	I98 M99 V101 F116 V130 K131 C132	I98-K114 CarbonylContact C-O 3.58Å; I98-K114 WeakPolarHBondContact CA-O 3.49Å; M99-K114 PolarHBondContact N-O 3.15Å; M99-K114 PolarHBondContact O-N 3.37Å; V101-K114 HydrophobicContact CG1-CB 4.33Å; K114-F116 HydrophobicContact CD-CE2 3.9Å; K114-F116 HydrophobicContact CD-CZ 3.91Å; K114-F116 HydrophobicContact CG-CE2 3.99Å; K114-F116 HydrophobicContact CG-CZ 4.36Å; K114-V130 HydrophobicContact CD-CG1 4.23Å; K114-V130 HydrophobicContact CG-CG1 4.05Å; K114-K131 CarbonylContact C-O 3.54Å; K114-K131 WeakPolarHBondContact CA-O 3.14Å; K114-C132 HydrophobicContact CB-CB 4.38Å
115	A	97.5	Very high	95.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.4	176.4	0	0	0	0	0	109.9	V130 K131 A139 I140 A143	A115-V130 WeakPolarHBondContact O-CA 3.42Å; A115-K131 PolarHBondContact N-O 2.89Å; A115-K131 PolarHBondContact O-N 3.41Å; A115-K131 VanDerWaalsContact O-N 3.15Å; A115-A139 HydrophobicContact CB-CB 3.94Å; A115-I140 HydrophobicContact CB-CG1 4.14Å; A115-A143 HydrophobicContact CB-CB 4.27Å
116	F	97.3	Very high	95.8	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.013	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.1	168.1	-65.7	-96.1	0	0	0	107.9	L96 K97 M99 K114 G129 V130 G223	L96-F116 HydrophobicContact CB-CB 4.21Å; L96-F116 PolarHBondContact N-O 3.45Å; K97-F116 PolarHBondContact O-N 2.97Å; M99-F116 HydrophobicContact CG-CE2 4.42Å; M99-F116 HydrophobicContact SD-CE2 3.89Å; K114-F116 HydrophobicContact CD-CE2 3.9Å; K114-F116 HydrophobicContact CD-CZ 3.91Å; K114-F116 HydrophobicContact CG-CE2 3.99Å; K114-F116 HydrophobicContact CG-CZ 4.36Å; F116-G129 WeakPolarHBondContact CA-O 3.49Å; F116-V130 HydrophobicContact CD1-CB 4.33Å; F116-V130 HydrophobicContact CD1-CG1 4.01Å; F116-V130 HydrophobicContact CD1-CG2 3.44Å; F116-V130 VanDerWaalsContact CD1-CG2 3.44Å; F116-V130 HydrophobicContact CE1-CB 4.38Å; F116-V130 HydrophobicContact CE1-CG1 3.73Å; F116-V130 HydrophobicContact CE1-CG2 3.65Å; F116-V130 HydrophobicContact CG-CG2 4.4Å; F116-V130 HydrophobicContact CZ-CG1 4.13Å; F116-G223 VanDerWaalsContact CZ-CA 3.47Å
117	V	97.4	Very high	95.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.9	-178.8	-178.7	0	0	0	0	108.4	D93 E94 V95 I119 G129 A143 I144	D93-V117 HydrophobicContact CB-CG1 4.22Å; E94-V117 WeakPolarHBondContact O-CA 3.19Å; V95-V117 HydrophobicContact CG2-CG2 4.21Å; V117-I119 HydrophobicContact CG1-CG1 4.35Å; V117-G129 PolarHBondContact N-O 3.31Å; V117-G129 PolarHBondContact O-N 3.31Å; V117-A143 HydrophobicContact CB-CB 4Å; V117-A143 HydrophobicContact CG2-CB 3.55Å; V117-I144 HydrophobicContact CG1-CG1 3.89Å
118	A	96.8	Very high	95.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	143.7	168.8	0	0	0	0	0	109	D93 E94 L96 G127 L202 M205	D93-A118 WeakPolarHBondContact CA-O 3.46Å; E94-A118 PolarHBondContact N-O 3.42Å; E94-A118 PolarHBondContact O-N 3.32Å; L96-A118 HydrophobicContact CD1-CB 4.17Å; L96-A118 HydrophobicContact CD2-CB 4.33Å; L96-A118 HydrophobicContact CG-CB 4.2Å; A118-G127 WeakPolarHBondContact CA-O 3.24Å; A118-L202 HydrophobicContact CB-CD2 3.59Å; A118-M205 HydrophobicContact CB-CE 4.36Å; A118-M205 HydrophobicContact CB-SD 3.53Å; A118-M205 VanDerWaalsContact CB-SD 3.53Å
119	I	96.6	Very high	96	Very high	3 Å²	3	40 Å²	40	2%	0.015	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143	174	-69.7	-175.7	0	0	0	107.8	L91 K92 D93 V117 V126 G127 I144 A147 K148	L91-I119 HydrophobicContact CB-CG2 4.16Å; L91-I119 HydrophobicContact CD1-CG2 4.19Å; L91-I119 HydrophobicContact CD2-CG2 3.77Å; L91-I119 HydrophobicContact CG-CG2 4.25Å; K92-I119 WeakPolarHBondContact O-CA 3.5Å; D93-I119 HydrophobicContact CB-CD1 4.37Å; D93-I119 HydrophobicContact CB-CG1 3.85Å; V117-I119 HydrophobicContact CG1-CG1 4.35Å; I119-V126 CarbonylContact O-C 3.6Å; I119-V126 WeakPolarHBondContact O-CA 3.45Å; I119-G127 PolarHBondContact N-O 2.89Å; I119-G127 PolarHBondContact O-N 3.04Å; I119-I144 HydrophobicContact CD1-CB 4.33Å; I119-I144 HydrophobicContact CD1-CG2 3.8Å; I119-I144 WeakPolarHBondContact CD1-O 3.47Å; I119-A147 HydrophobicContact CB-CB 4.1Å; I119-A147 HydrophobicContact CD1-CB 3.56Å; I119-A147 HydrophobicContact CG1-CB 3.7Å; I119-K148 HydrophobicContact CD1-CG 3.78Å
120	G	95.4	Very high	96.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168	168	169.2	0	0	0	0	0	113.1	K92 H125	K92-G120 PolarHBondContact N-O 3.46Å; K92-G120 PolarHBondContact O-N 3.46Å; K92-G120 VanDerWaalsContact O-N 3.09Å; G120-H125 WeakPolarHBondContact CA-O 3.49Å
121	D	94	Very high	96.2	Very high	19 Å²	19	33.6 Å²	33.6	10%	0.102	16%	0.159	C	C	.	.			trans	-106	3.7	-177.3	68.4	-16.3	0	0	0	113.2	L91 N123 G124 H125	L91-D121 HydrophobicContact CD2-CB 4.17Å; D121-N123 PolarHBondContact O-N 2.77Å; D121-N123 VanDerWaalsContact O-N 3.08Å; D121-N123 WeakPolarHBondContact OD1-CA 3.49Å; D121-N123 PolarHBondContact OD1-N 3.32Å; D121-G124 PolarHBondContact OD1-N 2.86Å; D121-H125 PolarHBondContact N-O 3.43Å; D121-H125 WeakPolarHBondContact OD1-CB 3.24Å; D121-H125 IonicContact OD1-CG 2.75Å; D121-H125 PolarHBondContact OD1-N 3.16Å; D121-H125 IonicContact OD1-ND1 2.86Å; D121-H125 IonicContact OD2-CE1 2.77Å; D121-H125 IonicContact OD2-CG 2.63Å; D121-H125 IonicContact OD2-ND1 3.66Å; D121-H125 PolarHBondContact OD2-ND1 3.27Å
122	Y	94.1	Very high	96.2	Very high	95 Å²	95	32.4 Å²	32.4	37%	0.373	15%	0.153	S	C	.	.	S	Bend	trans	59	12.1	-171.9	-57	-99.3	0	0	0	113.7	K92 T204 M205 G207	K92-Y122 HydrophobicContact CB-CE2 4.02Å; K92-Y122 HydrophobicContact CD-CE2 3.62Å; K92-Y122 HydrophobicContact CG-CE2 3.88Å; Y122-T204 HydrophobicContact CD1-CG2 4.04Å; Y122-T204 VanDerWaalsContact CD1-O 3.3Å; Y122-T204 WeakPolarHBondContact CD1-O 3.26Å; Y122-T204 HydrophobicContact CE1-CG2 3.79Å; Y122-M205 VanDerWaalsContact CA-O 3.28Å; Y122-M205 WeakPolarHBondContact CA-O 3.38Å; Y122-M205 PolarHBondContact N-O 3.07Å; Y122-G207 WeakPolarHBondContact O-CA 3.48Å
123	N	92.9	Very high	96.2	Very high	99 Å²	99	27.9 Å²	27.9	53%	0.529	14%	0.139	S	C	.	.	S	Bend	trans	-134.8	37.7	-173.5	-165	28.9	0	0	0	112.5	D121 R156	D121-N123 PolarHBondContact O-N 2.77Å; D121-N123 VanDerWaalsContact O-N 3.08Å; D121-N123 WeakPolarHBondContact OD1-CA 3.49Å; D121-N123 PolarHBondContact OD1-N 3.32Å; N123-R156 PolarHBondContact OD1-NH2 3.24Å
124	G	92.1	Very high	96.1	Very high	6 Å²	6	31.7 Å²	31.7	6%	0.062	16%	0.155	C	C	.	.	S	Bend	trans	93.7	14.9	173.4	0	0	0	0	0	114.6	D121 P153 V154 A206	D121-G124 PolarHBondContact OD1-N 2.86Å; G124-P153 CarbonylContact O-C 3.47Å; G124-P153 WeakPolarHBondContact O-CA 3.37Å; G124-V154 PolarHBondContact O-N 3.28Å; G124-A206 VanDerWaalsContact CA-O 3.28Å; G124-A206 WeakPolarHBondContact CA-O 3.48Å; G124-A206 PolarHBondContact N-O 3.07Å; G124-A206 VanDerWaalsContact N-O 3.17Å
125	H	95.4	Very high	96	Very high	24 Å²	24	34.3 Å²	34.3	11%	0.111	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.3	168.6	-58.5	95.5	0	0	0	110.8	Y71 L87 G120 D121 I151	Y71-H125 AromaticContact CE2-CD2 3.9Å; Y71-H125 AromaticContact CE2-NE2 3.82Å; L87-H125 HydrophobicContact CD1-CB 4.14Å; G120-H125 WeakPolarHBondContact CA-O 3.49Å; D121-H125 PolarHBondContact N-O 3.43Å; D121-H125 WeakPolarHBondContact OD1-CB 3.24Å; D121-H125 IonicContact OD1-CG 2.75Å; D121-H125 PolarHBondContact OD1-N 3.16Å; D121-H125 IonicContact OD1-ND1 2.86Å; D121-H125 IonicContact OD2-CE1 2.77Å; D121-H125 IonicContact OD2-CG 2.63Å; D121-H125 IonicContact OD2-ND1 3.66Å; D121-H125 PolarHBondContact OD2-ND1 3.27Å; H125-I151 HydrophobicContact CB-CD1 3.81Å; H125-I151 HydrophobicContact CB-CG1 3.99Å
126	V	96.7	Very high	96	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.5	173.9	71.7	0	0	0	0	110.4	I119 I151 V152 V154 L202 M205 A206 F230 I233	I119-V126 CarbonylContact O-C 3.6Å; I119-V126 WeakPolarHBondContact O-CA 3.45Å; V126-I151 WeakPolarHBondContact O-CA 3.37Å; V126-V152 PolarHBondContact N-O 3.1Å; V126-V152 PolarHBondContact O-N 3.34Å; V126-V154 HydrophobicContact CB-CG2 4.41Å; V126-V154 HydrophobicContact CG1-CG2 3.73Å; V126-L202 HydrophobicContact CG2-CD2 4.21Å; V126-M205 HydrophobicContact CG2-CB 4.22Å; V126-A206 HydrophobicContact CB-CB 4.27Å; V126-A206 HydrophobicContact CG1-CB 4.37Å; V126-F230 HydrophobicContact CG1-CD2 4.18Å; V126-F230 HydrophobicContact CG1-CE2 4.02Å; V126-F230 WeakPolarHBondContact O-CE2 3.44Å; V126-I233 HydrophobicContact CG1-CD1 4.32Å; V126-I233 HydrophobicContact CG1-CG2 3.73Å
127	G	96.7	Very high	96	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.6	176.6	0	0	0	0	0	110.6	A118 I119 A147	A118-G127 WeakPolarHBondContact CA-O 3.24Å; I119-G127 PolarHBondContact N-O 2.89Å; I119-G127 PolarHBondContact O-N 3.04Å; G127-A147 WeakPolarHBondContact CA-O 3.37Å
128	L	97.2	Very high	95.9	Very high	17 Å²	17	41.1 Å²	41.1	9%	0.089	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	118.9	175.6	-177.7	70.1	0	0	0	109.9	L96 S150 L202 A226 K227 F230	L96-L128 HydrophobicContact CD1-CD1 3.98Å; L128-S150 PolarHBondContact N-OG 2.89Å; L128-S150 PolarHBondContact O-OG 3.11Å; L128-L202 HydrophobicContact CD1-CD2 4.49Å; L128-A226 HydrophobicContact CD1-CB 4.46Å; L128-A226 HydrophobicContact CD2-CB 4.36Å; L128-K227 HydrophobicContact CD2-CB 4.44Å; L128-K227 HydrophobicContact CD2-CG 3.81Å; L128-F230 HydrophobicContact CB-CB 4.35Å; L128-F230 HydrophobicContact CB-CD1 4.42Å; L128-F230 HydrophobicContact CB-CD2 3.72Å; L128-F230 HydrophobicContact CB-CE2 4.12Å; L128-F230 HydrophobicContact CB-CG 3.89Å; L128-F230 HydrophobicContact CD2-CB 3.97Å; L128-F230 HydrophobicContact CD2-CG 4.31Å
129	G	96.9	Very high	95.9	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.9	-179.2	0	0	0	0	0	111.8	F116 V117 A143	F116-G129 WeakPolarHBondContact CA-O 3.49Å; V117-G129 PolarHBondContact N-O 3.31Å; V117-G129 PolarHBondContact O-N 3.31Å; G129-A143 WeakPolarHBondContact CA-O 3.42Å
130	V	97.2	Very high	96	Very high	38 Å²	38	42.8 Å²	42.8	23%	0.23	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	115.2	175.4	-173.4	0	0	0	0	109.3	K114 A115 F116 L146	K114-V130 HydrophobicContact CD-CG1 4.23Å; K114-V130 HydrophobicContact CG-CG1 4.05Å; A115-V130 WeakPolarHBondContact O-CA 3.42Å; F116-V130 HydrophobicContact CD1-CB 4.33Å; F116-V130 HydrophobicContact CD1-CG1 4.01Å; F116-V130 HydrophobicContact CD1-CG2 3.44Å; F116-V130 VanDerWaalsContact CD1-CG2 3.44Å; F116-V130 HydrophobicContact CE1-CB 4.38Å; F116-V130 HydrophobicContact CE1-CG1 3.73Å; F116-V130 HydrophobicContact CE1-CG2 3.65Å; F116-V130 HydrophobicContact CG-CG2 4.4Å; F116-V130 HydrophobicContact CZ-CG1 4.13Å; V130-L146 WeakPolarHBondContact O-CD1 3.47Å
131	K	97.7	Very high	96	Very high	90 Å²	90	50.3 Å²	50.3	39%	0.391	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.7	178	-167.9	71.4	179.8	-172.9	0	110.9	K114 A115 A139 A143 L146	K114-K131 CarbonylContact C-O 3.54Å; K114-K131 WeakPolarHBondContact CA-O 3.14Å; A115-K131 PolarHBondContact N-O 2.89Å; A115-K131 PolarHBondContact O-N 3.41Å; A115-K131 VanDerWaalsContact O-N 3.15Å; K131-A139 WeakPolarHBondContact CB-O 3.44Å; K131-A143 HydrophobicContact CB-CB 3.89Å; K131-L146 HydrophobicContact CB-CD1 4.21Å; K131-L146 HydrophobicContact CD-CD1 3.71Å
132	C	96.6	Very high	96.1	Very high	41 Å²	41	50.2 Å²	50.2	28%	0.277	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126	172.1	-175	0	0	0	0	110.2	R112 F113 K114	R112-C132 VanDerWaalsContact CB-SG 3.55Å; F113-C132 CarbonylContact O-C 3.55Å; F113-C132 VanDerWaalsContact O-CA 3.24Å; F113-C132 WeakPolarHBondContact O-CA 3.04Å; K114-C132 HydrophobicContact CB-CB 4.38Å
133	S	97.1	Very high	96.3	Very high	22 Å²	22	45.7 Å²	45.7	15%	0.154	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	169.3	-179.2	-59.7	0	0	0	0	110.8	R112 F113 E135 T138	R112-S133 WeakPolarHBondContact CA-O 3.42Å; R112-S133 WeakPolarHBondContact CB-O 3.06Å; F113-S133 PolarHBondContact N-O 3.38Å; F113-S133 PolarHBondContact O-N 3.41Å; S133-E135 VanDerWaalsContact C-N 3.34Å; S133-T138 VanDerWaalsContact CB-OG1 3.25Å; S133-T138 WeakPolarHBondContact CB-OG1 3.37Å
134	K	95.7	Very high	96.5	Very high	140 Å²	140	42.5 Å²	42.5	61%	0.609	22%	0.22	S	C	*	.	S	Bend	trans	-69.3	-34.3	176.1	-67.4	-178.6	-178.9	177.6	0	112.1	R110 F113	R110-K134 VanDerWaalsContact NH2-CE 3.34Å; F113-K134 WeakPolarHBondContact CD2-O 3.34Å
135	E	95.7	Very high	96.7	Very high	123 Å²	123	46 Å²	46	58%	0.575	24%	0.236	S	C	*	.	S	Bend	trans	-112	149	-179.7	-63.7	168	-168.9	0	0	110.2	S133 T138 A139	S133-E135 VanDerWaalsContact C-N 3.34Å; E135-T138 HydrophobicContact CB-CG2 4.37Å; E135-T138 PolarHBondContact O-OG1 3.23Å; E135-A139 PolarHBondContact O-N 3.25Å; E135-A139 VanDerWaalsContact O-N 3.1Å
136	V	96.7	Very high	96.8	Very high	50 Å²	50	47.8 Å²	47.8	30%	0.303	25%	0.246	S	C	.	.	H	α-helix	trans	-65.3	-47.3	-178.9	178.1	0	0	0	0	111.1	I98 F113 T138 A139 I140	I98-V136 HydrophobicContact CD1-CG1 3.76Å; I98-V136 HydrophobicContact CG2-CG1 4.33Å; F113-V136 HydrophobicContact CB-CG2 3.98Å; F113-V136 HydrophobicContact CD1-CG2 3.84Å; F113-V136 HydrophobicContact CD2-CG2 3.65Å; F113-V136 HydrophobicContact CE1-CG2 4.23Å; F113-V136 HydrophobicContact CE2-CG2 4.06Å; F113-V136 HydrophobicContact CG-CG2 3.52Å; F113-V136 HydrophobicContact CZ-CG2 4.32Å; V136-T138 VanDerWaalsContact C-N 3.31Å; V136-T138 PolarHBondContact O-N 3.13Å; V136-A139 WeakPolarHBondContact O-CB 3.33Å; V136-A139 PolarHBondContact O-N 2.93Å; V136-A139 VanDerWaalsContact O-N 3.08Å; V136-I140 HydrophobicContact CG1-CD1 3.79Å; V136-I140 HydrophobicContact CG1-CG1 4.36Å; V136-I140 WeakPolarHBondContact O-CG1 3.45Å; V136-I140 PolarHBondContact O-N 3.06Å
137	A	96.1	Very high	96.8	Very high	44 Å²	44	47.8 Å²	47.8	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-39.3	-178.2	0	0	0	0	0	112.5	I140 R141	A137-I140 PolarHBondContact O-N 3.41Å; A137-R141 WeakPolarHBondContact O-CG 3.47Å; A137-R141 PolarHBondContact O-N 3.1Å
138	T	96.7	Very high	96.7	Very high	52 Å²	52	49.5 Å²	49.5	32%	0.319	25%	0.254	S	S	.	.	H	α-helix	trans	-71.9	-31.2	176.2	58.5	0	0	0	0	112.4	S133 E135 V136 G142	S133-T138 VanDerWaalsContact CB-OG1 3.25Å; S133-T138 WeakPolarHBondContact CB-OG1 3.37Å; E135-T138 HydrophobicContact CB-CG2 4.37Å; E135-T138 PolarHBondContact O-OG1 3.23Å; V136-T138 VanDerWaalsContact C-N 3.31Å; V136-T138 PolarHBondContact O-N 3.13Å; T138-G142 PolarHBondContact O-N 2.92Å; T138-G142 VanDerWaalsContact O-N 3.11Å
139	A	97.4	Very high	96.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66	-44.4	172.1	0	0	0	0	0	111.3	A115 K131 E135 V136 G142 A143	A115-A139 HydrophobicContact CB-CB 3.94Å; K131-A139 WeakPolarHBondContact CB-O 3.44Å; E135-A139 PolarHBondContact O-N 3.25Å; E135-A139 VanDerWaalsContact O-N 3.1Å; V136-A139 WeakPolarHBondContact O-CB 3.33Å; V136-A139 PolarHBondContact O-N 2.93Å; V136-A139 VanDerWaalsContact O-N 3.08Å; A139-G142 PolarHBondContact O-N 2.8Å; A139-A143 VanDerWaalsContact O-CB 3.25Å; A139-A143 WeakPolarHBondContact O-CB 3.33Å; A139-A143 PolarHBondContact O-N 2.82Å
140	I	97	Very high	96.6	Very high	38 Å²	38	52.9 Å²	52.9	20%	0.195	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-53.1	179.6	-65.6	168.5	0	0	0	110.5	V95 I98 A115 V136 A137 G142 A143 I144	V95-I140 HydrophobicContact CG2-CG2 4.09Å; I98-I140 HydrophobicContact CD1-CD1 4.13Å; A115-I140 HydrophobicContact CB-CG1 4.14Å; V136-I140 HydrophobicContact CG1-CD1 3.79Å; V136-I140 HydrophobicContact CG1-CG1 4.36Å; V136-I140 WeakPolarHBondContact O-CG1 3.45Å; V136-I140 PolarHBondContact O-N 3.06Å; A137-I140 PolarHBondContact O-N 3.41Å; I140-G142 VanDerWaalsContact C-N 3.29Å; I140-G142 PolarHBondContact O-N 3Å; I140-A143 WeakPolarHBondContact O-CB 3.43Å; I140-A143 PolarHBondContact O-N 2.87Å; I140-I144 HydrophobicContact CG2-CD1 3.94Å; I140-I144 HydrophobicContact CG2-CG1 4.48Å; I140-I144 WeakPolarHBondContact O-CG1 3.49Å; I140-I144 PolarHBondContact O-N 2.86Å
141	R	96.6	Very high	96.5	Very high	158 Å²	158	51.4 Å²	51.4	60%	0.596	27%	0.265	S	S	*	.	H	α-helix	trans	-56.4	-44.1	178.1	-68.3	-178.5	-167.1	112.8	0.5	112.2	A137 A143 I144 I145	A137-R141 WeakPolarHBondContact O-CG 3.47Å; A137-R141 PolarHBondContact O-N 3.1Å; R141-A143 VanDerWaalsContact C-N 3.33Å; R141-A143 PolarHBondContact O-N 2.84Å; R141-I144 PolarHBondContact O-N 2.74Å; R141-I145 WeakPolarHBondContact O-CG1 3.49Å; R141-I145 PolarHBondContact O-N 3.31Å; R141-I145 VanDerWaalsContact O-N 3.17Å
142	G	96.7	Very high	96.3	Very high	16 Å²	16	48.9 Å²	48.9	17%	0.165	26%	0.257	C	S	.	.	H	α-helix	trans	-68.7	-30.2	177	0	0	0	0	0	113.6	T138 A139 I140 L146	T138-G142 PolarHBondContact O-N 2.92Å; T138-G142 VanDerWaalsContact O-N 3.11Å; A139-G142 PolarHBondContact O-N 2.8Å; I140-G142 VanDerWaalsContact C-N 3.29Å; I140-G142 PolarHBondContact O-N 3Å; G142-L146 WeakPolarHBondContact O-CG 3.49Å; G142-L146 PolarHBondContact O-N 3.13Å; G142-L146 VanDerWaalsContact O-N 3.13Å
143	A	97.4	Very high	96.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-72.6	-37.9	174.7	0	0	0	0	0	111.5	A115 V117 G129 K131 A139 I140 R141 L146 A147	A115-A143 HydrophobicContact CB-CB 4.27Å; V117-A143 HydrophobicContact CB-CB 4Å; V117-A143 HydrophobicContact CG2-CB 3.55Å; G129-A143 WeakPolarHBondContact CA-O 3.42Å; K131-A143 HydrophobicContact CB-CB 3.89Å; A139-A143 VanDerWaalsContact O-CB 3.25Å; A139-A143 WeakPolarHBondContact O-CB 3.33Å; A139-A143 PolarHBondContact O-N 2.82Å; I140-A143 WeakPolarHBondContact O-CB 3.43Å; I140-A143 PolarHBondContact O-N 2.87Å; R141-A143 VanDerWaalsContact C-N 3.33Å; R141-A143 PolarHBondContact O-N 2.84Å; A143-L146 PolarHBondContact O-N 2.76Å; A143-A147 WeakPolarHBondContact O-CB 3.28Å; A143-A147 PolarHBondContact O-N 2.85Å
144	I	96.8	Very high	96.2	Very high	33 Å²	33	47.3 Å²	47.3	17%	0.169	25%	0.246	C	C	.	.	H	α-helix	trans	-58.2	-49.9	173.2	-69.4	166.5	0	0	0	110.2	D93 V117 I119 I140 R141 L146 A147 K148	D93-I144 HydrophobicContact CB-CG1 4.36Å; V117-I144 HydrophobicContact CG1-CG1 3.89Å; I119-I144 HydrophobicContact CD1-CB 4.33Å; I119-I144 HydrophobicContact CD1-CG2 3.8Å; I119-I144 WeakPolarHBondContact CD1-O 3.47Å; I140-I144 HydrophobicContact CG2-CD1 3.94Å; I140-I144 HydrophobicContact CG2-CG1 4.48Å; I140-I144 WeakPolarHBondContact O-CG1 3.49Å; I140-I144 PolarHBondContact O-N 2.86Å; R141-I144 PolarHBondContact O-N 2.74Å; I144-L146 VanDerWaalsContact C-N 3.33Å; I144-L146 PolarHBondContact O-N 2.84Å; I144-A147 WeakPolarHBondContact O-CB 3.42Å; I144-A147 PolarHBondContact O-N 2.89Å; I144-A147 VanDerWaalsContact O-N 3.14Å; I144-K148 WeakPolarHBondContact O-CG 3.44Å; I144-K148 PolarHBondContact O-N 2.75Å
145	I	96.4	Very high	96.2	Very high	78 Å²	78	41.7 Å²	41.7	40%	0.4	22%	0.221	S	C	.	.	H	α-helix	trans	-58.5	-46.1	177.5	-66.6	166.5	0	0	0	110.9	R141 A147 K148 L149	R141-I145 WeakPolarHBondContact O-CG1 3.49Å; R141-I145 PolarHBondContact O-N 3.31Å; R141-I145 VanDerWaalsContact O-N 3.17Å; I145-A147 VanDerWaalsContact C-N 3.33Å; I145-A147 PolarHBondContact O-N 3.05Å; I145-K148 PolarHBondContact O-N 2.45Å; I145-L149 HydrophobicContact CG2-CD1 4.48Å; I145-L149 WeakPolarHBondContact O-CG 3.28Å; I145-L149 PolarHBondContact O-N 2.79Å; I145-L149 VanDerWaalsContact O-N 3.13Å
146	L	96.8	Very high	96.1	Very high	63 Å²	63	39.2 Å²	39.2	33%	0.33	21%	0.206	S	C	.	.	H	α-helix	trans	-65.2	-34.5	177.7	-74.3	179.8	0	0	0	113.1	V130 K131 G142 A143 I144 L149 S150	V130-L146 WeakPolarHBondContact O-CD1 3.47Å; K131-L146 HydrophobicContact CB-CD1 4.21Å; K131-L146 HydrophobicContact CD-CD1 3.71Å; G142-L146 WeakPolarHBondContact O-CG 3.49Å; G142-L146 PolarHBondContact O-N 3.13Å; G142-L146 VanDerWaalsContact O-N 3.13Å; A143-L146 PolarHBondContact O-N 2.76Å; I144-L146 VanDerWaalsContact C-N 3.33Å; I144-L146 PolarHBondContact O-N 2.84Å; L146-L149 HydrophobicContact CD2-CD1 4.38Å; L146-L149 PolarHBondContact O-N 2.64Å; L146-S150 PolarHBondContact O-N 2.77Å; L146-S150 VanDerWaalsContact O-N 3.1Å; L146-S150 PolarHBondContact O-OG 2.87Å; L146-S150 VanDerWaalsContact O-OG 3.07Å
147	A	96.8	Very high	95.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.9	-38.3	176.3	0	0	0	0	0	111.6	I119 G127 A143 I144 I145 S150 I151	I119-A147 HydrophobicContact CB-CB 4.1Å; I119-A147 HydrophobicContact CD1-CB 3.56Å; I119-A147 HydrophobicContact CG1-CB 3.7Å; G127-A147 WeakPolarHBondContact CA-O 3.37Å; A143-A147 WeakPolarHBondContact O-CB 3.28Å; A143-A147 PolarHBondContact O-N 2.85Å; I144-A147 WeakPolarHBondContact O-CB 3.42Å; I144-A147 PolarHBondContact O-N 2.89Å; I144-A147 VanDerWaalsContact O-N 3.14Å; I145-A147 VanDerWaalsContact C-N 3.33Å; I145-A147 PolarHBondContact O-N 3.05Å; A147-S150 CarbonylContact O-C 3.54Å; A147-S150 PolarHBondContact O-N 2.84Å; A147-S150 PolarHBondContact O-OG 2.94Å; A147-I151 PolarHBondContact O-N 3.43Å
148	K	96.2	Very high	95.8	Very high	36 Å²	36	38.1 Å²	38.1	16%	0.157	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-47.3	172.6	-67.8	177.8	-179.9	-176.6	0	110.8	I83 D84 I119 I144 I145 S150 I151	I83-K148 HydrophobicContact CB-CB 4.26Å; I83-K148 WeakPolarHBondContact CG1-O 3.21Å; I83-K148 HydrophobicContact CG2-CB 4.21Å; I83-K148 HydrophobicContact CG2-CG 4.38Å; D84-K148 WeakPolarHBondContact OD1-CD 3.21Å; D84-K148 WeakPolarHBondContact OD1-CE 3.29Å; D84-K148 IonicContact OD1-NZ 3.73Å; D84-K148 PolarHBondContact OD1-NZ 2.81Å; D84-K148 IonicContact OD2-NZ 3.12Å; D84-K148 PolarHBondContact OD2-NZ 2.72Å; I119-K148 HydrophobicContact CD1-CG 3.78Å; I144-K148 WeakPolarHBondContact O-CG 3.44Å; I144-K148 PolarHBondContact O-N 2.75Å; I145-K148 PolarHBondContact O-N 2.45Å; K148-S150 PolarHBondContact O-N 3.12Å; K148-I151 WeakPolarHBondContact O-CB 3.43Å; K148-I151 VanDerWaalsContact O-CG2 3.24Å; K148-I151 WeakPolarHBondContact O-CG2 3.35Å; K148-I151 PolarHBondContact O-N 3.09Å
149	L	95.8	Very high	95.5	Very high	51 Å²	51	43.2 Å²	43.2	27%	0.267	20%	0.203	S	C	.	.	H	α-helix	trans	-63.6	-26.7	178.8	-65.2	177.2	0	0	0	113.8	I77 K78 E79 I145 L146	I77-L149 HydrophobicContact CG2-CD2 4.11Å; K78-L149 VanDerWaalsContact C-CD2 3.45Å; E79-L149 VanDerWaalsContact C-CD2 3.48Å; I145-L149 HydrophobicContact CG2-CD1 4.48Å; I145-L149 WeakPolarHBondContact O-CG 3.28Å; I145-L149 PolarHBondContact O-N 2.79Å; I145-L149 VanDerWaalsContact O-N 3.13Å; L146-L149 HydrophobicContact CD2-CD1 4.38Å; L146-L149 PolarHBondContact O-N 2.64Å
150	S	95.4	Very high	95	Very high	37 Å²	37	45.5 Å²	45.5	26%	0.259	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	18.8	179.8	67.5	0	0	0	0	113.4	L128 L146 A147 K148 F230	L128-S150 PolarHBondContact N-OG 2.89Å; L128-S150 PolarHBondContact O-OG 3.11Å; L146-S150 PolarHBondContact O-N 2.77Å; L146-S150 VanDerWaalsContact O-N 3.1Å; L146-S150 PolarHBondContact O-OG 2.87Å; L146-S150 VanDerWaalsContact O-OG 3.07Å; A147-S150 CarbonylContact O-C 3.54Å; A147-S150 PolarHBondContact O-N 2.84Å; A147-S150 PolarHBondContact O-OG 2.94Å; K148-S150 PolarHBondContact O-N 3.12Å; S150-F230 VanDerWaalsContact O-CZ 3.28Å; S150-F230 WeakPolarHBondContact O-CZ 3.48Å
151	I	94.7	Very high	94.5	Very high	7 Å²	7	50 Å²	50	4%	0.036	25%	0.251	C	S	.	.			trans	-68.8	134.8	178.8	-157.9	166.2	0	0	0	110.3	Y71 I83 L87 L91 H125 V126 A147 K148	Y71-I151 WeakPolarHBondContact OH-CG2 3.44Å; I83-I151 HydrophobicContact CD1-CG2 3.49Å; I83-I151 VanDerWaalsContact CD1-CG2 3.49Å; I83-I151 HydrophobicContact CG1-CG2 3.95Å; I83-I151 HydrophobicContact CG2-CD1 4.31Å; I83-I151 HydrophobicContact CG2-CG2 4.34Å; L87-I151 HydrophobicContact CD1-CD1 3.95Å; L91-I151 HydrophobicContact CD2-CD1 3.86Å; H125-I151 HydrophobicContact CB-CD1 3.81Å; H125-I151 HydrophobicContact CB-CG1 3.99Å; V126-I151 WeakPolarHBondContact O-CA 3.37Å; A147-I151 PolarHBondContact O-N 3.43Å; K148-I151 WeakPolarHBondContact O-CB 3.43Å; K148-I151 VanDerWaalsContact O-CG2 3.24Å; K148-I151 WeakPolarHBondContact O-CG2 3.35Å; K148-I151 PolarHBondContact O-N 3.09Å
152	V	94.6	Very high	94	Very high	38 Å²	38	50.2 Å²	50.2	23%	0.23	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.3	-174	174.9	0	0	0	0	108.6	V126 F230	V126-V152 PolarHBondContact N-O 3.1Å; V126-V152 PolarHBondContact O-N 3.34Å; V152-F230 HydrophobicContact CB-CZ 4.21Å; V152-F230 HydrophobicContact CG2-CE1 4.39Å; V152-F230 HydrophobicContact CG2-CZ 3.78Å
153	P	95.8	Very high	93.5	Very high	26 Å²	26	54.8 Å²	54.8	17%	0.169	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	145.4	175	32.1	-36.1	0	0	0	110.4	Y71 G124 Y237	Y71-P153 HydrophobicContact CD1-CG 4.35Å; Y71-P153 HydrophobicContact CD2-CB 3.92Å; Y71-P153 HydrophobicContact CD2-CG 3.69Å; Y71-P153 HydrophobicContact CE2-CB 3.83Å; Y71-P153 HydrophobicContact CE2-CG 3.9Å; Y71-P153 HydrophobicContact CG-CG 3.94Å; G124-P153 CarbonylContact O-C 3.47Å; G124-P153 WeakPolarHBondContact O-CA 3.37Å; P153-Y237 HydrophobicContact CB-CD2 4.28Å; P153-Y237 HydrophobicContact CB-CE2 3.75Å; P153-Y237 HydrophobicContact CG-CD2 4.12Å; P153-Y237 HydrophobicContact CG-CE2 4.06Å; P153-Y237 WeakPolarHBondContact O-CD2 3.4Å
154	V	95.6	Very high	93	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.024	30%	0.304	C	S	.	.			trans	-113.3	121.4	-178.9	-175.4	0	0	0	0	109.8	G124 V126 R156 A206 I208 I233	G124-V154 PolarHBondContact O-N 3.28Å; V126-V154 HydrophobicContact CB-CG2 4.41Å; V126-V154 HydrophobicContact CG1-CG2 3.73Å; V154-R156 PolarHBondContact O-N 3.2Å; V154-A206 HydrophobicContact CB-CB 4.35Å; V154-A206 HydrophobicContact CG1-CB 4.17Å; V154-A206 HydrophobicContact CG2-CB 3.86Å; V154-I208 HydrophobicContact CG1-CD1 4.01Å; V154-I208 HydrophobicContact CG1-CG1 4.42Å; V154-I233 HydrophobicContact CB-CG2 3.99Å; V154-I233 HydrophobicContact CG1-CG2 3.67Å; V154-I233 HydrophobicContact CG2-CG2 3.25Å
155	R	94.7	Very high	92.8	Very high	21 Å²	21	64.1 Å²	64.1	8%	0.079	33%	0.332	C	S	.	.			trans	-80.7	119.2	176.7	-166.5	176.4	172.8	-158.8	-2.3	109	P170 T236 Y237 Y239 T241 D243 L244	R155-P170 HydrophobicContact CB-CG 4.32Å; R155-P170 HydrophobicContact CG-CG 4.1Å; R155-P170 WeakPolarHBondContact O-CD 3.24Å; R155-T236 PolarHBondContact N-OG1 3.28Å; R155-T236 VanDerWaalsContact N-OG1 3.1Å; R155-Y237 HydrophobicContact CB-CD1 3.94Å; R155-Y237 HydrophobicContact CB-CD2 3.77Å; R155-Y237 HydrophobicContact CB-CE1 3.74Å; R155-Y237 HydrophobicContact CB-CE2 3.59Å; R155-Y237 HydrophobicContact CB-CG 3.93Å; R155-Y237 HydrophobicContact CG-CD1 4.18Å; R155-Y237 HydrophobicContact CG-CE1 3.8Å; R155-Y237 HydrophobicContact CG-CE2 4.48Å; R155-Y239 PolarHBondContact NH1-O 2.61Å; R155-T241 VanDerWaalsContact CZ-OG1 3.3Å; R155-T241 PolarHBondContact NH1-OG1 3.31Å; R155-T241 PolarHBondContact NH2-OG1 2.65Å; R155-D243 VanDerWaalsContact NH2-CG 3.3Å; R155-D243 IonicContact NH2-OD1 3.69Å; R155-D243 PolarHBondContact NH2-OD1 2.98Å; R155-D243 VanDerWaalsContact NH2-OD1 3.12Å; R155-D243 IonicContact NH2-OD2 3.58Å; R155-D243 PolarHBondContact NH2-OD2 2.95Å; R155-L244 VanDerWaalsContact NH1-CD1 3.31Å
156	R	94.9	Very high	92.7	Very high	71 Å²	71	62.5 Å²	62.5	27%	0.268	33%	0.326	S	S	.	.			trans	-98.3	151.7	170.3	-63	-179.8	-67.7	-175.3	-6.4	109.9	N123 V154 P166 T168 G207 I208	N123-R156 PolarHBondContact OD1-NH2 3.24Å; V154-R156 PolarHBondContact O-N 3.2Å; R156-P166 HydrophobicContact CB-CB 3.63Å; R156-T168 CarbonylContact C-O 3.56Å; R156-T168 WeakPolarHBondContact CA-O 3.46Å; R156-G207 WeakPolarHBondContact CD-O 3.26Å; R156-G207 PolarHBondContact NH1-O 2.88Å; R156-I208 HydrophobicContact CG-CG1 4.36Å
157	G	92.6	Very high	92.5	Very high	7 Å²	7	59.7 Å²	59.7	7%	0.072	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-146.7	-160.3	-178.1	0	0	0	0	0	112	P166 H167 T168	G157-P166 WeakPolarHBondContact O-CA 3.42Å; G157-H167 PolarHBondContact O-N 3.01Å; G157-T168 PolarHBondContact N-O 3.31Å; G157-T168 PolarHBondContact O-N 3.3Å
158	Y	92.6	Very high	92.5	Very high	64 Å²	64	59.7 Å²	59.7	25%	0.251	31%	0.311	S	S	.	.			trans	-123	149.2	-176.3	-57.5	-88.7	0	0	0	109.2	K162 G164 P166	Y158-K162 HydrophobicContact CD2-CB 4.18Å; Y158-K162 HydrophobicContact CD2-CG 3.83Å; Y158-K162 HydrophobicContact CE1-CB 4.49Å; Y158-K162 HydrophobicContact CE2-CB 4.17Å; Y158-K162 HydrophobicContact CE2-CG 4.15Å; Y158-K162 HydrophobicContact CG-CB 4.34Å; Y158-K162 HydrophobicContact CG-CG 4.19Å; Y158-G164 WeakPolarHBondContact CE1-O 3.32Å; Y158-G164 PolarHBondContact OH-O 3.39Å; Y158-P166 HydrophobicContact CE2-CB 4.42Å; Y158-P166 HydrophobicContact CE2-CG 4.05Å; Y158-P166 WeakPolarHBondContact OH-CD 3.21Å
159	W	90.3	Very high	92.4	Very high	160 Å²	160	58 Å²	58	61%	0.606	30%	0.304	S	S	*	.	S	Bend	trans	-75.4	-40.1	174.5	179.1	72.1	0	0	0	112.6	T168 A187 P188	W159-T168 HydrophobicContact CB-CG2 4.1Å; W159-A187 WeakPolarHBondContact CB-O 3.35Å; W159-P188 HydrophobicContact CD2-CB 3.96Å; W159-P188 HydrophobicContact CE3-CB 3.77Å; W159-P188 HydrophobicContact CG-CB 4.48Å; W159-P188 HydrophobicContact CZ3-CB 4.06Å
160	G	88.2	Confident	92.3	Very high	48 Å²	48	57 Å²	57	50%	0.495	30%	0.301	S	S	.	.	S	Bend	trans	-143.9	-103.6	179.5	0	0	0	0	0	110.3
161	N	86.6	Confident	92.1	Very high	132 Å²	132	56.1 Å²	56.1	71%	0.706	29%	0.294	S	S	*	.	S	Bend	trans	-62.6	138.4	179.2	-69.9	-4.2	0	0	0	111.9	I163	N161-I163 HydrophobicContact CB-CD1 3.66Å; N161-I163 HydrophobicContact CB-CG1 3.84Å; N161-I163 PolarHBondContact O-N 3.33Å
162	K	85.3	Confident	92.2	Very high	162 Å²	162	61.7 Å²	61.7	70%	0.704	32%	0.319	S	S	*	.			trans	-78.8	60.4	178.8	-61.6	-177.1	-179	180	0	111.5	Y158	Y158-K162 HydrophobicContact CD2-CB 4.18Å; Y158-K162 HydrophobicContact CD2-CG 3.83Å; Y158-K162 HydrophobicContact CE1-CB 4.49Å; Y158-K162 HydrophobicContact CE2-CB 4.17Å; Y158-K162 HydrophobicContact CE2-CG 4.15Å; Y158-K162 HydrophobicContact CG-CB 4.34Å; Y158-K162 HydrophobicContact CG-CG 4.19Å
163	I	86.1	Confident	92.2	Very high	112 Å²	112	60.2 Å²	60.2	57%	0.574	31%	0.31	S	S	*	.			trans	-102.2	127	-177.2	-59.4	167.4	0	0	0	109.4	N161 R189	N161-I163 HydrophobicContact CB-CD1 3.66Å; N161-I163 HydrophobicContact CB-CG1 3.84Å; N161-I163 PolarHBondContact O-N 3.33Å; I163-R189 PolarHBondContact O-NH1 3.14Å
164	G	88	Confident	92.2	Very high	58 Å²	58	62.7 Å²	62.7	60%	0.598	32%	0.324	S	S	*	.	S	Bend	trans	72.5	-151.7	177.5	0	0	0	0	0	113.2	Y158	Y158-G164 WeakPolarHBondContact CE1-O 3.32Å; Y158-G164 PolarHBondContact OH-O 3.39Å
165	K	91.4	Very high	92.3	Very high	172 Å²	172	62.5 Å²	62.5	75%	0.748	32%	0.323	S	S	*	.	S	Bend	trans	-78.5	148.3	177.8	-64.4	-179.5	-179	178.9	0	111.3	H167 R189	K165-H167 PolarHBondContact O-N 2.75Å; K165-R189 PolarHBondContact O-NH1 3.31Å
166	P	94.1	Very high	92.4	Very high	43 Å²	43	69.6 Å²	69.6	28%	0.279	35%	0.35	S	S	.	.			trans	-56.6	133.8	170.3	-21.3	32	0	0	0	110.8	R156 G157 Y158	R156-P166 HydrophobicContact CB-CB 3.63Å; G157-P166 WeakPolarHBondContact O-CA 3.42Å; Y158-P166 HydrophobicContact CE2-CB 4.42Å; Y158-P166 HydrophobicContact CE2-CG 4.05Å; Y158-P166 WeakPolarHBondContact OH-CD 3.21Å
167	H	93.9	Very high	92.4	Very high	4 Å²	4	67.5 Å²	67.5	2%	0.019	35%	0.346	C	S	.	.			trans	-131.7	-21.3	-168.6	69.6	98.5	0	0	0	113.7	G157 K165 A187 R189 D209 D210	G157-H167 PolarHBondContact O-N 3.01Å; K165-H167 PolarHBondContact O-N 2.75Å; H167-A187 PolarHBondContact CE1-O 3.29Å; H167-A187 VanDerWaalsContact CE1-O 3.22Å; H167-R189 WeakPolarHBondContact CE1-CG 3.43Å; H167-R189 WeakPolarHBondContact NE2-CG 3.37Å; H167-D209 HydrophobicContact CB-CB 4.39Å; H167-D209 PolarHBondContact O-N 3.23Å; H167-D210 IonicContact CE1-OD2 2.64Å; H167-D210 IonicContact CG-OD2 3.42Å; H167-D210 IonicContact ND1-OD2 2.71Å; H167-D210 PolarHBondContact ND1-OD2 3.3Å; H167-D210 PolarHBondContact O-N 3.1Å
168	T	95	Very high	92.6	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-126.2	-180	-176.6	-166.1	0	0	0	0	111.6	R156 G157 W159 P186 A187 D210	R156-T168 CarbonylContact C-O 3.56Å; R156-T168 WeakPolarHBondContact CA-O 3.46Å; G157-T168 PolarHBondContact N-O 3.31Å; G157-T168 PolarHBondContact O-N 3.3Å; W159-T168 HydrophobicContact CB-CG2 4.1Å; T168-P186 HydrophobicContact CG2-CB 4.07Å; T168-P186 WeakPolarHBondContact OG1-CA 3.34Å; T168-A187 PolarHBondContact OG1-N 3.5Å; T168-A187 VanDerWaalsContact OG1-N 3.07Å; T168-D210 WeakPolarHBondContact CA-O 3.49Å; T168-D210 WeakPolarHBondContact CB-O 3.25Å; T168-D210 PolarHBondContact OG1-O 3Å
169	V	94.3	Very high	92.7	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.38	C	S	.	.			trans	-72.3	143.3	173.1	-68.9	0	0	0	0	110.8	C171 L184 P186 I208	V169-C171 PolarHBondContact O-N 2.94Å; V169-L184 HydrophobicContact CG1-CB 4.17Å; V169-L184 HydrophobicContact CG1-CD1 4.09Å; V169-L184 HydrophobicContact CG2-CB 4.19Å; V169-P186 HydrophobicContact CG2-CB 4.32Å; V169-P186 HydrophobicContact CG2-CG 3.93Å; V169-P186 WeakPolarHBondContact O-CB 3.38Å; V169-P186 WeakPolarHBondContact O-CG 3.43Å; V169-I208 HydrophobicContact CG1-CD1 3.79Å
170	P	93.4	Very high	93	Very high	31 Å²	31	62.5 Å²	62.5	20%	0.201	35%	0.351	C	S	.	.	S	Bend	trans	-70.7	-29.6	-174.5	26.9	-35.9	0	0	0	113.6	R155	R155-P170 HydrophobicContact CB-CG 4.32Å; R155-P170 HydrophobicContact CG-CG 4.1Å; R155-P170 WeakPolarHBondContact O-CD 3.24Å
171	C	92.6	Very high	93.4	Very high	18 Å²	18	63.7 Å²	63.7	12%	0.122	35%	0.346	C	S	.	.	S	Bend	trans	-147.9	168.7	179.9	58	0	0	0	0	109.9	V169 V173 Y239	V169-C171 PolarHBondContact O-N 2.94Å; C171-V173 PolarHBondContact O-N 3.07Å; C171-V173 VanDerWaalsContact O-N 3.14Å; C171-Y239 HydrophobicContact CB-CD1 4.08Å; C171-Y239 HydrophobicContact CB-CE1 4.25Å; C171-Y239 WeakPolarHBondContact SG-CD1 3.37Å; C171-Y239 VanDerWaalsContact SG-CG 3.52Å
172	K	95.5	Very high	93.9	Very high	125 Å²	125	57.5 Å²	57.5	54%	0.543	31%	0.313	S	S	.	.			trans	-72.3	106.6	175.4	-64.9	177.6	-173.2	172.4	0	108.9	L184 I185	K172-L184 WeakPolarHBondContact CA-O 3.31Å; K172-I185 HydrophobicContact CG-CG1 4.44Å; K172-I185 HydrophobicContact CG-CG2 4.34Å
173	V	95.6	Very high	94.5	Very high	7 Å²	7	55.1 Å²	55.1	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146.1	-179.5	-66.3	0	0	0	0	111.3	C171 R183 L184 A232 T236	C171-V173 PolarHBondContact O-N 3.07Å; C171-V173 VanDerWaalsContact O-N 3.14Å; V173-R183 CarbonylContact O-C 3.6Å; V173-R183 WeakPolarHBondContact O-CA 3.43Å; V173-L184 HydrophobicContact CG2-CB 3.72Å; V173-L184 HydrophobicContact CG2-CD1 3.88Å; V173-L184 HydrophobicContact CG2-CG 4.07Å; V173-L184 PolarHBondContact N-O 2.83Å; V173-L184 VanDerWaalsContact N-O 3.16Å; V173-L184 PolarHBondContact O-N 3.43Å; V173-A232 HydrophobicContact CG2-CB 4.44Å; V173-A232 WeakPolarHBondContact CG2-O 3.32Å; V173-T236 HydrophobicContact CG1-CG2 4.4Å; V173-T236 HydrophobicContact CG2-CG2 4.09Å
174	T	96.5	Very high	95	Very high	78 Å²	78	49.8 Å²	49.8	48%	0.479	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.6	178.5	48.9	0	0	0	0	110.8	V182 R183 K235	T174-V182 CarbonylContact C-O 3.27Å; T174-V182 WeakPolarHBondContact CA-O 3.46Å; T174-R183 HydrophobicContact CG2-CB 3.91Å; T174-R183 HydrophobicContact CG2-CG 3.68Å; T174-K235 WeakPolarHBondContact O-CD 3.49Å
175	G	96.8	Very high	95.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	148.8	172.9	0	0	0	0	0	111.6	L181 V182 A228 D231	G175-L181 WeakPolarHBondContact O-CA 3.48Å; G175-V182 PolarHBondContact N-O 3.44Å; G175-V182 PolarHBondContact O-N 2.83Å; G175-A228 WeakPolarHBondContact CA-O 3.39Å; G175-D231 WeakPolarHBondContact CA-OD2 3.36Å
176	R	96.4	Very high	95.6	Very high	170 Å²	170	41.9 Å²	41.9	64%	0.642	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	135.6	-175.9	-171.6	177.9	179.7	179.1	0.1	111.6	G178 V180 L181 D231	R176-G178 PolarHBondContact NE-O 3.29Å; R176-V180 WeakPolarHBondContact CA-O 3.28Å; R176-L181 HydrophobicContact CB-CD2 3.7Å; R176-L181 HydrophobicContact CG-CD2 3.62Å; R176-L181 HydrophobicContact CG-CG 4.48Å; R176-D231 PolarHBondContact N-OD2 3.19Å
177	C	96.3	Very high	95.7	Very high	26 Å²	26	39.8 Å²	39.8	18%	0.176	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	116.4	165.6	-169.4	0	0	0	0	110	S179 V180 N224 K227 A228	C177-S179 PolarHBondContact O-N 3.17Å; C177-V180 PolarHBondContact N-O 3.48Å; C177-V180 PolarHBondContact O-N 3.13Å; C177-N224 HydrophobicContact CB-CB 4.38Å; C177-N224 WeakPolarHBondContact CB-O 3.47Å; C177-K227 HydrophobicContact CB-CB 3.94Å; C177-A228 HydrophobicContact CB-CB 3.83Å
178	G	95.1	Very high	95.7	Very high	52 Å²	52	41.5 Å²	41.5	54%	0.536	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	-126.1	-170.9	0	0	0	0	0	111.5	R176	R176-G178 PolarHBondContact NE-O 3.29Å
179	S	94.9	Very high	95.6	Very high	74 Å²	74	47.7 Å²	47.7	52%	0.517	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-7.1	174.2	60.5	0	0	0	0	113.9	C177	C177-S179 PolarHBondContact O-N 3.17Å
180	V	97.4	Very high	95.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	126.4	-176.5	-172.5	0	0	0	0	110	R176 C177 V182 R216 C218 T219 N224 F225 A228	R176-V180 WeakPolarHBondContact CA-O 3.28Å; C177-V180 PolarHBondContact N-O 3.48Å; C177-V180 PolarHBondContact O-N 3.13Å; V180-V182 HydrophobicContact CG1-CG2 4.25Å; V180-R216 WeakPolarHBondContact CA-O 3.3Å; V180-C218 VanDerWaalsContact CG2-O 3.26Å; V180-C218 WeakPolarHBondContact CG2-O 3.13Å; V180-T219 HydrophobicContact CG1-CG2 4.22Å; V180-N224 HydrophobicContact CG2-CB 4.18Å; V180-F225 HydrophobicContact CG1-CB 4.47Å; V180-F225 HydrophobicContact CG1-CD2 3.78Å; V180-A228 HydrophobicContact CB-CB 4.42Å; V180-A228 HydrophobicContact CG1-CB 4.22Å
181	L	96.8	Very high	95.5	Very high	74 Å²	74	51.8 Å²	51.8	39%	0.387	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.2	173	-71.3	168.1	0	0	0	108.8	G175 R176 A215 R216	G175-L181 WeakPolarHBondContact O-CA 3.48Å; R176-L181 HydrophobicContact CB-CD2 3.7Å; R176-L181 HydrophobicContact CG-CD2 3.62Å; R176-L181 HydrophobicContact CG-CG 4.48Å; L181-A215 CarbonylContact O-C 3.52Å; L181-A215 VanDerWaalsContact O-CA 3.28Å; L181-A215 WeakPolarHBondContact O-CA 3.19Å; L181-R216 PolarHBondContact N-O 3Å; L181-R216 PolarHBondContact O-N 2.86Å
182	V	97.4	Very high	95.6	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.2	174.8	-178.9	0	0	0	0	108.2	T174 G175 V180 L184 F225 A228	T174-V182 CarbonylContact C-O 3.27Å; T174-V182 WeakPolarHBondContact CA-O 3.46Å; G175-V182 PolarHBondContact N-O 3.44Å; G175-V182 PolarHBondContact O-N 2.83Å; V180-V182 HydrophobicContact CG1-CG2 4.25Å; V182-L184 HydrophobicContact CG1-CD2 4.3Å; V182-F225 HydrophobicContact CG2-CD2 3.73Å; V182-F225 HydrophobicContact CG2-CE2 3.65Å; V182-A228 HydrophobicContact CB-CB 4.47Å; V182-A228 HydrophobicContact CG2-CB 3.83Å
183	R	97.3	Very high	95.6	Very high	113 Å²	113	47.5 Å²	47.5	43%	0.426	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.2	176.1	-170.7	175.5	-167.9	-178.5	6.7	109.1	V173 T174 I185 T213 S214	V173-R183 CarbonylContact O-C 3.6Å; V173-R183 WeakPolarHBondContact O-CA 3.43Å; T174-R183 HydrophobicContact CG2-CB 3.91Å; T174-R183 HydrophobicContact CG2-CG 3.68Å; R183-I185 HydrophobicContact CG-CD1 4.41Å; R183-I185 HydrophobicContact CG-CG1 3.96Å; R183-T213 WeakPolarHBondContact O-CA 3.22Å; R183-S214 PolarHBondContact N-O 3.29Å; R183-S214 PolarHBondContact O-N 3.49Å
184	L	96.9	Very high	95.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.5	169.3	-53.5	179.6	0	0	0	108.1	V169 K172 V173 V182 L203 T213 A232 I233	V169-L184 HydrophobicContact CG1-CB 4.17Å; V169-L184 HydrophobicContact CG1-CD1 4.09Å; V169-L184 HydrophobicContact CG2-CB 4.19Å; K172-L184 WeakPolarHBondContact CA-O 3.31Å; V173-L184 HydrophobicContact CG2-CB 3.72Å; V173-L184 HydrophobicContact CG2-CD1 3.88Å; V173-L184 HydrophobicContact CG2-CG 4.07Å; V173-L184 PolarHBondContact N-O 2.83Å; V173-L184 VanDerWaalsContact N-O 3.16Å; V173-L184 PolarHBondContact O-N 3.43Å; V182-L184 HydrophobicContact CG1-CD2 4.3Å; L184-L203 HydrophobicContact CD1-CD2 3.92Å; L184-L203 HydrophobicContact CD2-CD1 4.06Å; L184-L203 HydrophobicContact CD2-CD2 3.96Å; L184-T213 HydrophobicContact CD2-CG2 3.77Å; L184-A232 HydrophobicContact CD1-CB 3.89Å; L184-A232 HydrophobicContact CG-CB 3.96Å; L184-I233 HydrophobicContact CD1-CG1 4.04Å
185	I	96.5	Very high	95.6	Very high	43 Å²	43	48.3 Å²	48.3	22%	0.221	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.8	-176.9	-60	170.6	0	0	0	107.4	K172 R183 C211 Y212	K172-I185 HydrophobicContact CG-CG1 4.44Å; K172-I185 HydrophobicContact CG-CG2 4.34Å; R183-I185 HydrophobicContact CG-CD1 4.41Å; R183-I185 HydrophobicContact CG-CG1 3.96Å; I185-C211 PolarHBondContact O-SG 2.89Å; I185-Y212 PolarHBondContact N-O 3.11Å; I185-Y212 PolarHBondContact O-N 3.39Å
186	P	95.6	Very high	95.5	Very high	20 Å²	20	50.6 Å²	50.6	13%	0.13	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	139.8	176.6	-19.9	27.6	0	0	0	111.4	T168 V169	T168-P186 HydrophobicContact CG2-CB 4.07Å; T168-P186 WeakPolarHBondContact OG1-CA 3.34Å; V169-P186 HydrophobicContact CG2-CB 4.32Å; V169-P186 HydrophobicContact CG2-CG 3.93Å; V169-P186 WeakPolarHBondContact O-CB 3.38Å; V169-P186 WeakPolarHBondContact O-CG 3.43Å
187	A	95.6	Very high	95.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	30%	0.298	C	S	.	.			trans	-128.2	149.8	-179.2	0	0	0	0	0	111.2	W159 H167 T168 T191 D210 Y212	W159-A187 WeakPolarHBondContact CB-O 3.35Å; H167-A187 PolarHBondContact CE1-O 3.29Å; H167-A187 VanDerWaalsContact CE1-O 3.22Å; T168-A187 PolarHBondContact OG1-N 3.5Å; T168-A187 VanDerWaalsContact OG1-N 3.07Å; A187-T191 HydrophobicContact CB-CG2 4.15Å; A187-D210 HydrophobicContact CB-CB 4.13Å; A187-Y212 HydrophobicContact CB-CD2 3.65Å; A187-Y212 HydrophobicContact CB-CE2 3.75Å; A187-Y212 HydrophobicContact CB-CG 4.21Å
188	P	94.6	Very high	95.2	Very high	39 Å²	39	47.1 Å²	47.1	25%	0.253	30%	0.297	S	S	.	.			trans	-64.2	159.8	177.5	25.3	-30.7	0	0	0	112	W159 G190 T191	W159-P188 HydrophobicContact CD2-CB 3.96Å; W159-P188 HydrophobicContact CE3-CB 3.77Å; W159-P188 HydrophobicContact CG-CB 4.48Å; W159-P188 HydrophobicContact CZ3-CB 4.06Å; P188-G190 PolarHBondContact O-N 2.84Å; P188-T191 WeakPolarHBondContact CD-OG1 3.39Å; P188-T191 WeakPolarHBondContact CG-OG1 3.36Å; P188-T191 WeakPolarHBondContact O-CB 3.42Å; P188-T191 PolarHBondContact O-N 2.71Å; P188-T191 PolarHBondContact O-OG1 3.42Å
189	R	92.1	Very high	95.2	Very high	130 Å²	130	44.7 Å²	44.7	49%	0.491	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	134.5	-178	-65.5	-168.7	81.7	101.3	17.2	111.3	I163 K165 H167 D210	I163-R189 PolarHBondContact O-NH1 3.14Å; K165-R189 PolarHBondContact O-NH1 3.31Å; H167-R189 WeakPolarHBondContact CE1-CG 3.43Å; H167-R189 WeakPolarHBondContact NE2-CG 3.37Å; R189-D210 WeakPolarHBondContact CA-OD2 3.28Å
190	G	92.2	Very high	95.2	Very high	75 Å²	75	45.9 Å²	45.9	77%	0.773	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	6.7	177	0	0	0	0	0	114.5	P188 G192 D210	P188-G190 PolarHBondContact O-N 2.84Å; G190-G192 VanDerWaalsContact C-N 3.3Å; G190-D210 WeakPolarHBondContact CA-OD1 3.21Å; G190-D210 PolarHBondContact N-OD1 3.15Å; G190-D210 PolarHBondContact N-OD2 2.87Å
191	T	93.4	Very high	95.1	Very high	43 Å²	43	49.4 Å²	49.4	26%	0.264	28%	0.283	S	S	.	.			trans	-69.4	-32.4	172.2	-53.7	0	0	0	0	111.4	A187 P188 V194 D210 Y212	A187-T191 HydrophobicContact CB-CG2 4.15Å; P188-T191 WeakPolarHBondContact CD-OG1 3.39Å; P188-T191 WeakPolarHBondContact CG-OG1 3.36Å; P188-T191 WeakPolarHBondContact O-CB 3.42Å; P188-T191 PolarHBondContact O-N 2.71Å; P188-T191 PolarHBondContact O-OG1 3.42Å; T191-V194 HydrophobicContact CG2-CG2 4.09Å; T191-D210 PolarHBondContact N-OD1 3.06Å; T191-Y212 HydrophobicContact CG2-CD1 4.37Å; T191-Y212 HydrophobicContact CG2-CE1 3.56Å; T191-Y212 HydrophobicContact CG2-CE2 4.42Å
192	G	94.6	Very high	95.1	Very high	27 Å²	27	45.9 Å²	45.9	28%	0.278	27%	0.265	S	S	.	.			trans	70.8	-174.1	-167.5	0	0	0	0	0	112.9	G190 V194 D209 D210 C211	G190-G192 VanDerWaalsContact C-N 3.3Å; G192-V194 PolarHBondContact O-N 2.98Å; G192-D209 CarbonylContact C-O 3.59Å; G192-D209 VanDerWaalsContact C-O 3.27Å; G192-D209 VanDerWaalsContact CA-O 3.31Å; G192-D209 WeakPolarHBondContact CA-O 3.39Å; G192-D210 PolarHBondContact N-OD1 3.45Å; G192-C211 PolarHBondContact O-N 2.84Å
193	I	96.4	Very high	95	Very high	25 Å²	25	45.9 Å²	45.9	13%	0.128	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	104.3	-179.8	-51.6	173.3	0	0	0	109.8	S195 K200 L203 T204 I208 D209	I193-S195 PolarHBondContact O-N 3.43Å; I193-K200 HydrophobicContact CB-CG 4.23Å; I193-K200 HydrophobicContact CG2-CB 4.37Å; I193-K200 HydrophobicContact CG2-CG 4.01Å; I193-L203 HydrophobicContact CD1-CB 3.99Å; I193-L203 HydrophobicContact CG2-CB 4.14Å; I193-L203 HydrophobicContact CG2-CD1 3.71Å; I193-T204 VanDerWaalsContact CD1-OG1 3.24Å; I193-T204 WeakPolarHBondContact CD1-OG1 3.45Å; I193-I208 VanDerWaalsContact CD1-O 3.27Å; I193-I208 WeakPolarHBondContact CD1-O 3.43Å; I193-D209 WeakPolarHBondContact CG1-O 3.08Å; I193-D209 PolarHBondContact N-O 2.95Å
194	V	96.3	Very high	94.9	Very high	75 Å²	75	43 Å²	43	46%	0.455	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	89.4	174.8	-174.2	0	0	0	0	108.7	T191 G192 C211 Y212 T213	T191-V194 HydrophobicContact CG2-CG2 4.09Å; G192-V194 PolarHBondContact O-N 2.98Å; V194-C211 PolarHBondContact N-O 3.05Å; V194-Y212 HydrophobicContact CB-CD1 3.99Å; V194-Y212 HydrophobicContact CB-CE1 4.48Å; V194-Y212 HydrophobicContact CG1-CD1 4.48Å; V194-Y212 HydrophobicContact CG2-CD1 3.96Å; V194-Y212 HydrophobicContact CG2-CE1 3.98Å; V194-T213 PolarHBondContact O-N 3.35Å; V194-T213 PolarHBondContact O-OG1 2.83Å
195	S	94.4	Very high	94.9	Very high	28 Å²	28	43.2 Å²	43.2	20%	0.196	26%	0.261	C	S	.	.	S	Bend	trans	-152.6	157.9	-176.6	174.7	0	0	0	0	112.6	I193 P199 K200 T213	I193-S195 PolarHBondContact O-N 3.43Å; S195-P199 VanDerWaalsContact OG-CB 3.25Å; S195-P199 WeakPolarHBondContact OG-CB 3.34Å; S195-P199 WeakPolarHBondContact OG-CG 3.34Å; S195-K200 PolarHBondContact OG-N 3.23Å; S195-T213 VanDerWaalsContact CA-OG1 3.25Å; S195-T213 WeakPolarHBondContact CA-OG1 3.48Å; S195-T213 VanDerWaalsContact CB-OG1 3.3Å; S195-T213 WeakPolarHBondContact CB-OG1 3.38Å
196	A	94.3	Very high	94.8	Very high	47 Å²	47	41.1 Å²	41.1	39%	0.388	25%	0.25	S	S	.	.			trans	-56.3	155.8	161.5	0	0	0	0	0	111.4	V198 P199 K200 F225	A196-V198 VanDerWaalsContact C-N 3.29Å; A196-V198 PolarHBondContact O-N 2.7Å; A196-V198 VanDerWaalsContact O-N 3.14Å; A196-P199 WeakPolarHBondContact O-CD 3.45Å; A196-K200 VanDerWaalsContact O-CB 3.27Å; A196-K200 WeakPolarHBondContact O-CB 3.25Å; A196-K200 PolarHBondContact O-N 2.72Å; A196-F225 HydrophobicContact CB-CE1 3.93Å; A196-F225 HydrophobicContact CB-CZ 4.08Å
197	P	94.1	Very high	94.7	Very high	98 Å²	98	40.5 Å²	40.5	64%	0.636	25%	0.247	S	C	*	.	H	α-helix	trans	-56.6	-35.4	-170.8	-28.3	34.9	0	0	0	115.4	K201	P197-K201 WeakPolarHBondContact O-CG 3.37Å; P197-K201 PolarHBondContact O-N 3.41Å
198	V	93.5	Very high	94.7	Very high	25 Å²	25	40.6 Å²	40.6	15%	0.152	25%	0.247	C	C	.	.	H	α-helix	trans	-71.3	-56.9	-175.8	174.1	0	0	0	0	112	A196 K200 K201 L202 L222 F225 A226	A196-V198 VanDerWaalsContact C-N 3.29Å; A196-V198 PolarHBondContact O-N 2.7Å; A196-V198 VanDerWaalsContact O-N 3.14Å; V198-K200 PolarHBondContact O-N 3.42Å; V198-K201 PolarHBondContact O-N 3.17Å; V198-L202 PolarHBondContact O-N 3.38Å; V198-L222 HydrophobicContact CG1-CD2 4.43Å; V198-L222 HydrophobicContact CG1-CG 4.13Å; V198-L222 HydrophobicContact CG2-CD1 3.42Å; V198-L222 VanDerWaalsContact CG2-CD1 3.42Å; V198-L222 HydrophobicContact CG2-CG 3.82Å; V198-F225 HydrophobicContact CB-CD1 4.23Å; V198-F225 HydrophobicContact CB-CE1 4.44Å; V198-F225 HydrophobicContact CG1-CD1 4.45Å; V198-A226 HydrophobicContact CG1-CB 3.96Å
199	P	95	Very high	94.7	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-29.6	173.2	-6.4	7.5	0	0	0	112.8	S195 A196 K201 L202 L203 F225 T229	S195-P199 VanDerWaalsContact OG-CB 3.25Å; S195-P199 WeakPolarHBondContact OG-CB 3.34Å; S195-P199 WeakPolarHBondContact OG-CG 3.34Å; A196-P199 WeakPolarHBondContact O-CD 3.45Å; P199-K201 PolarHBondContact O-N 2.82Å; P199-L202 PolarHBondContact O-N 2.9Å; P199-L203 WeakPolarHBondContact O-CB 3.41Å; P199-L203 VanDerWaalsContact O-CG 3.31Å; P199-L203 WeakPolarHBondContact O-CG 3.33Å; P199-L203 PolarHBondContact O-N 2.86Å; P199-F225 HydrophobicContact CG-CD1 4.21Å; P199-F225 HydrophobicContact CG-CE1 3.43Å; P199-F225 VanDerWaalsContact CG-CE1 3.43Å; P199-F225 HydrophobicContact CG-CE2 3.8Å; P199-F225 HydrophobicContact CG-CZ 3.2Å; P199-T229 HydrophobicContact CB-CG2 3.62Å; P199-T229 WeakPolarHBondContact CB-OG1 3.46Å
200	K	95.7	Very high	94.9	Very high	99 Å²	99	37 Å²	37	43%	0.43	24%	0.236	S	C	.	.	H	α-helix	trans	-57.1	-49.5	176.6	-174.6	170.1	-177.1	172	0	110.9	I193 S195 A196 V198 L202 L203 T204	I193-K200 HydrophobicContact CB-CG 4.23Å; I193-K200 HydrophobicContact CG2-CB 4.37Å; I193-K200 HydrophobicContact CG2-CG 4.01Å; S195-K200 PolarHBondContact OG-N 3.23Å; A196-K200 VanDerWaalsContact O-CB 3.27Å; A196-K200 WeakPolarHBondContact O-CB 3.25Å; A196-K200 PolarHBondContact O-N 2.72Å; V198-K200 PolarHBondContact O-N 3.42Å; K200-L202 PolarHBondContact O-N 2.71Å; K200-L203 PolarHBondContact O-N 2.93Å; K200-T204 PolarHBondContact O-N 3.09Å; K200-T204 PolarHBondContact O-OG1 3.14Å
201	K	95.4	Very high	95.1	Very high	75 Å²	75	33.5 Å²	33.5	33%	0.326	20%	0.199	S	C	.	.	H	α-helix	trans	-57.6	-45.2	175.9	-69.7	170.4	176.1	-154.2	0	112.5	E94 L96 P197 V198 P199 L203 T204 M205	E94-K201 WeakPolarHBondContact OE1-CD 3.41Å; E94-K201 WeakPolarHBondContact OE1-CE 3.42Å; E94-K201 IonicContact OE1-NZ 3.76Å; E94-K201 PolarHBondContact OE1-NZ 3.4Å; L96-K201 HydrophobicContact CD2-CB 4.25Å; L96-K201 HydrophobicContact CD2-CD 3.96Å; P197-K201 WeakPolarHBondContact O-CG 3.37Å; P197-K201 PolarHBondContact O-N 3.41Å; V198-K201 PolarHBondContact O-N 3.17Å; P199-K201 PolarHBondContact O-N 2.82Å; K201-L203 PolarHBondContact O-N 3.44Å; K201-T204 PolarHBondContact O-N 2.91Å; K201-M205 WeakPolarHBondContact O-CB 3.33Å; K201-M205 WeakPolarHBondContact O-CG 3.48Å; K201-M205 PolarHBondContact O-N 3.16Å
202	L	95.6	Very high	95.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-41.5	177.9	-72	172.6	0	0	0	112.7	A118 V126 L128 V198 P199 K200 M205 A206 A226 T229 I233	A118-L202 HydrophobicContact CB-CD2 3.59Å; V126-L202 HydrophobicContact CG2-CD2 4.21Å; L128-L202 HydrophobicContact CD1-CD2 4.49Å; V198-L202 PolarHBondContact O-N 3.38Å; P199-L202 PolarHBondContact O-N 2.9Å; K200-L202 PolarHBondContact O-N 2.71Å; L202-M205 PolarHBondContact O-N 3.22Å; L202-A206 WeakPolarHBondContact O-CB 3.38Å; L202-A206 PolarHBondContact O-N 3.49Å; L202-A226 HydrophobicContact CD1-CB 4.2Å; L202-A226 WeakPolarHBondContact CD1-O 3.35Å; L202-T229 HydrophobicContact CB-CG2 4.17Å; L202-T229 HydrophobicContact CD1-CG2 3.91Å; L202-I233 HydrophobicContact CB-CD1 4.33Å
203	L	95.9	Very high	95.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-70	-37.7	178.1	-69	171.1	0	0	0	111.9	L184 I193 P199 K200 K201 A206 G207 I208 C211 T213 I233	L184-L203 HydrophobicContact CD1-CD2 3.92Å; L184-L203 HydrophobicContact CD2-CD1 4.06Å; L184-L203 HydrophobicContact CD2-CD2 3.96Å; I193-L203 HydrophobicContact CD1-CB 3.99Å; I193-L203 HydrophobicContact CG2-CB 4.14Å; I193-L203 HydrophobicContact CG2-CD1 3.71Å; P199-L203 WeakPolarHBondContact O-CB 3.41Å; P199-L203 VanDerWaalsContact O-CG 3.31Å; P199-L203 WeakPolarHBondContact O-CG 3.33Å; P199-L203 PolarHBondContact O-N 2.86Å; K200-L203 PolarHBondContact O-N 2.93Å; K201-L203 PolarHBondContact O-N 3.44Å; L203-A206 WeakPolarHBondContact O-CB 3.48Å; L203-A206 PolarHBondContact O-N 2.78Å; L203-G207 PolarHBondContact O-N 3.38Å; L203-I208 HydrophobicContact CD2-CD1 3.66Å; L203-I208 PolarHBondContact O-N 2.89Å; L203-I208 VanDerWaalsContact O-N 3.09Å; L203-C211 HydrophobicContact CD1-CB 4.41Å; L203-T213 HydrophobicContact CD1-CG2 3.7Å; L203-I233 HydrophobicContact CD2-CD1 4.09Å; L203-I233 HydrophobicContact CD2-CG1 4.2Å
204	T	95.8	Very high	95.4	Very high	54 Å²	54	38.5 Å²	38.5	33%	0.331	22%	0.218	S	C	.	.	H	α-helix	trans	-63.8	-45.3	173.9	-51.3	0	0	0	0	111	Y122 I193 K200 K201 A206 G207	Y122-T204 HydrophobicContact CD1-CG2 4.04Å; Y122-T204 VanDerWaalsContact CD1-O 3.3Å; Y122-T204 WeakPolarHBondContact CD1-O 3.26Å; Y122-T204 HydrophobicContact CE1-CG2 3.79Å; I193-T204 VanDerWaalsContact CD1-OG1 3.24Å; I193-T204 WeakPolarHBondContact CD1-OG1 3.45Å; K200-T204 PolarHBondContact O-N 3.09Å; K200-T204 PolarHBondContact O-OG1 3.14Å; K201-T204 PolarHBondContact O-N 2.91Å; T204-A206 VanDerWaalsContact C-N 3.27Å; T204-A206 PolarHBondContact O-N 2.85Å; T204-G207 PolarHBondContact O-N 2.82Å
205	M	95.2	Very high	95.3	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-33.4	175.7	-75.8	-175.3	167.8	0	0	113.1	E94 A118 Y122 V126 K201 L202 G207	E94-M205 HydrophobicContact CB-CE 3.2Å; E94-M205 HydrophobicContact CG-CE 4.4Å; A118-M205 HydrophobicContact CB-CE 4.36Å; A118-M205 HydrophobicContact CB-SD 3.53Å; A118-M205 VanDerWaalsContact CB-SD 3.53Å; Y122-M205 VanDerWaalsContact CA-O 3.28Å; Y122-M205 WeakPolarHBondContact CA-O 3.38Å; Y122-M205 PolarHBondContact N-O 3.07Å; V126-M205 HydrophobicContact CG2-CB 4.22Å; K201-M205 WeakPolarHBondContact O-CB 3.33Å; K201-M205 WeakPolarHBondContact O-CG 3.48Å; K201-M205 PolarHBondContact O-N 3.16Å; L202-M205 PolarHBondContact O-N 3.22Å; M205-G207 PolarHBondContact O-N 2.91Å
206	A	94.6	Very high	95.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-9.8	172.9	0	0	0	0	0	113.6	G124 V126 V154 L202 L203 T204 I208 I233	G124-A206 VanDerWaalsContact CA-O 3.28Å; G124-A206 WeakPolarHBondContact CA-O 3.48Å; G124-A206 PolarHBondContact N-O 3.07Å; G124-A206 VanDerWaalsContact N-O 3.17Å; V126-A206 HydrophobicContact CB-CB 4.27Å; V126-A206 HydrophobicContact CG1-CB 4.37Å; V154-A206 HydrophobicContact CB-CB 4.35Å; V154-A206 HydrophobicContact CG1-CB 4.17Å; V154-A206 HydrophobicContact CG2-CB 3.86Å; L202-A206 WeakPolarHBondContact O-CB 3.38Å; L202-A206 PolarHBondContact O-N 3.49Å; L203-A206 WeakPolarHBondContact O-CB 3.48Å; L203-A206 PolarHBondContact O-N 2.78Å; T204-A206 VanDerWaalsContact C-N 3.27Å; T204-A206 PolarHBondContact O-N 2.85Å; A206-I208 HydrophobicContact CB-CD1 4.26Å; A206-I208 HydrophobicContact CB-CG1 4.4Å; A206-I233 HydrophobicContact CB-CD1 4.38Å
207	G	94.2	Very high	95.4	Very high	6 Å²	6	45.3 Å²	45.3	6%	0.062	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	25.3	-177.9	0	0	0	0	0	114.1	Y122 R156 L203 T204 M205	Y122-G207 WeakPolarHBondContact O-CA 3.48Å; R156-G207 WeakPolarHBondContact CD-O 3.26Å; R156-G207 PolarHBondContact NH1-O 2.88Å; L203-G207 PolarHBondContact O-N 3.38Å; T204-G207 PolarHBondContact O-N 2.82Å; M205-G207 PolarHBondContact O-N 2.91Å
208	I	95.5	Very high	95.4	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	24%	0.236	C	C	.	.			trans	-89.5	120.6	172.3	-64.7	165.9	0	0	0	108.1	V154 R156 V169 I193 L203 A206 C211	V154-I208 HydrophobicContact CG1-CD1 4.01Å; V154-I208 HydrophobicContact CG1-CG1 4.42Å; R156-I208 HydrophobicContact CG-CG1 4.36Å; V169-I208 HydrophobicContact CG1-CD1 3.79Å; I193-I208 VanDerWaalsContact CD1-O 3.27Å; I193-I208 WeakPolarHBondContact CD1-O 3.43Å; L203-I208 HydrophobicContact CD2-CD1 3.66Å; L203-I208 PolarHBondContact O-N 2.89Å; L203-I208 VanDerWaalsContact O-N 3.09Å; A206-I208 HydrophobicContact CB-CD1 4.26Å; A206-I208 HydrophobicContact CB-CG1 4.4Å; I208-C211 HydrophobicContact CG2-CB 3.95Å
209	D	94.4	Very high	95.4	Very high	87 Å²	87	45.3 Å²	45.3	47%	0.465	25%	0.246	S	C	.	.			trans	-84.7	-44.6	-177.2	-60.1	-41.3	0	0	0	111.3	H167 G192 I193	H167-D209 HydrophobicContact CB-CB 4.39Å; H167-D209 PolarHBondContact O-N 3.23Å; G192-D209 CarbonylContact C-O 3.59Å; G192-D209 VanDerWaalsContact C-O 3.27Å; G192-D209 VanDerWaalsContact CA-O 3.31Å; G192-D209 WeakPolarHBondContact CA-O 3.39Å; I193-D209 WeakPolarHBondContact CG1-O 3.08Å; I193-D209 PolarHBondContact N-O 2.95Å
210	D	95.6	Very high	95.2	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.043	28%	0.28	C	S	.	.			trans	-123.6	123.5	-173.5	-56.1	-69.3	0	0	0	110.8	H167 T168 A187 R189 G190 T191 G192	H167-D210 IonicContact CE1-OD2 2.64Å; H167-D210 IonicContact CG-OD2 3.42Å; H167-D210 IonicContact ND1-OD2 2.71Å; H167-D210 PolarHBondContact ND1-OD2 3.3Å; H167-D210 PolarHBondContact O-N 3.1Å; T168-D210 WeakPolarHBondContact CA-O 3.49Å; T168-D210 WeakPolarHBondContact CB-O 3.25Å; T168-D210 PolarHBondContact OG1-O 3Å; A187-D210 HydrophobicContact CB-CB 4.13Å; R189-D210 WeakPolarHBondContact CA-OD2 3.28Å; G190-D210 WeakPolarHBondContact CA-OD1 3.21Å; G190-D210 PolarHBondContact N-OD1 3.15Å; G190-D210 PolarHBondContact N-OD2 2.87Å; T191-D210 PolarHBondContact N-OD1 3.06Å; G192-D210 PolarHBondContact N-OD1 3.45Å
211	C	96.3	Very high	95.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	133.8	174.6	-168.6	0	0	0	0	111	I185 G192 V194 L203 I208	I185-C211 PolarHBondContact O-SG 2.89Å; G192-C211 PolarHBondContact O-N 2.84Å; V194-C211 PolarHBondContact N-O 3.05Å; L203-C211 HydrophobicContact CD1-CB 4.41Å; I208-C211 HydrophobicContact CG2-CB 3.95Å
212	Y	97.3	Very high	95	Very high	99 Å²	99	45.1 Å²	45.1	39%	0.388	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	138.9	161.4	-66.9	-58.6	0	0	0	109.1	I185 A187 T191 V194	I185-Y212 PolarHBondContact N-O 3.11Å; I185-Y212 PolarHBondContact O-N 3.39Å; A187-Y212 HydrophobicContact CB-CD2 3.65Å; A187-Y212 HydrophobicContact CB-CE2 3.75Å; A187-Y212 HydrophobicContact CB-CG 4.21Å; T191-Y212 HydrophobicContact CG2-CD1 4.37Å; T191-Y212 HydrophobicContact CG2-CE1 3.56Å; T191-Y212 HydrophobicContact CG2-CE2 4.42Å; V194-Y212 HydrophobicContact CB-CD1 3.99Å; V194-Y212 HydrophobicContact CB-CE1 4.48Å; V194-Y212 HydrophobicContact CG1-CD1 4.48Å; V194-Y212 HydrophobicContact CG2-CD1 3.96Å; V194-Y212 HydrophobicContact CG2-CE1 3.98Å
213	T	97.1	Very high	94.9	Very high	35 Å²	35	45.5 Å²	45.5	22%	0.215	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.6	175.3	66.5	0	0	0	0	110.5	R183 L184 V194 S195 L203	R183-T213 WeakPolarHBondContact O-CA 3.22Å; L184-T213 HydrophobicContact CD2-CG2 3.77Å; V194-T213 PolarHBondContact O-N 3.35Å; V194-T213 PolarHBondContact O-OG1 2.83Å; S195-T213 VanDerWaalsContact CA-OG1 3.25Å; S195-T213 WeakPolarHBondContact CA-OG1 3.48Å; S195-T213 VanDerWaalsContact CB-OG1 3.3Å; S195-T213 WeakPolarHBondContact CB-OG1 3.38Å; L203-T213 HydrophobicContact CD1-CG2 3.7Å
214	S	96.3	Very high	94.9	Very high	66 Å²	66	48.5 Å²	48.5	46%	0.462	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130	170	178.9	0	0	0	0	108.3	R183	R183-S214 PolarHBondContact N-O 3.29Å; R183-S214 PolarHBondContact O-N 3.49Å
215	A	95.6	Very high	94.9	Very high	47 Å²	47	46.7 Å²	46.7	39%	0.388	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.8	179.6	0	0	0	0	0	110.3	L181 T219 F225	L181-A215 CarbonylContact O-C 3.52Å; L181-A215 VanDerWaalsContact O-CA 3.28Å; L181-A215 WeakPolarHBondContact O-CA 3.19Å; A215-T219 HydrophobicContact CB-CG2 3.67Å; A215-F225 HydrophobicContact CB-CE2 3.67Å; A215-F225 HydrophobicContact CB-CZ 4.19Å
216	R	95.3	Very high	95	Very high	201 Å²	201	46.5 Å²	46.5	76%	0.758	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	148	176.8	-167.9	176.3	-177.2	-177.2	1.4	109.9	V180 L181	V180-R216 WeakPolarHBondContact CA-O 3.3Å; L181-R216 PolarHBondContact N-O 3Å; L181-R216 PolarHBondContact O-N 2.86Å
217	G	94.9	Very high	95.1	Very high	46 Å²	46	50.6 Å²	50.6	47%	0.474	29%	0.292	S	S	.	.	S	Bend	trans	98.5	-161.6	-177.5	0	0	0	0	0	113	T219	G217-T219 VanDerWaalsContact C-N 3.34Å; G217-T219 PolarHBondContact O-N 3.02Å
218	C	94.6	Very high	95.2	Very high	65 Å²	65	50.3 Å²	50.3	44%	0.439	29%	0.289	S	S	.	.			trans	-82.1	73.6	-175	-171.5	0	0	0	0	112.6	V180 A220 T221	V180-C218 VanDerWaalsContact CG2-O 3.26Å; V180-C218 WeakPolarHBondContact CG2-O 3.13Å; C218-A220 PolarHBondContact O-N 2.91Å; C218-T221 PolarHBondContact O-N 3.49Å; C218-T221 PolarHBondContact O-OG1 2.82Å
219	T	92.6	Very high	95.3	Very high	58 Å²	58	50.2 Å²	50.2	36%	0.356	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.9	-177.5	54.7	0	0	0	0	114.2	V180 A215 G217 T221 F225	V180-T219 HydrophobicContact CG1-CG2 4.22Å; A215-T219 HydrophobicContact CB-CG2 3.67Å; G217-T219 VanDerWaalsContact C-N 3.34Å; G217-T219 PolarHBondContact O-N 3.02Å; T219-T221 PolarHBondContact O-N 3.3Å; T219-F225 HydrophobicContact CG2-CD2 4.19Å; T219-F225 HydrophobicContact CG2-CE2 4.04Å
220	A	92.4	Very high	95.4	Very high	87 Å²	87	47.7 Å²	47.7	72%	0.719	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.6	173.9	0	0	0	0	0	112.8	C218 L222	C218-A220 PolarHBondContact O-N 2.91Å; A220-L222 PolarHBondContact O-N 3.3Å
221	T	93.4	Very high	95.4	Very high	58 Å²	58	49.3 Å²	49.3	36%	0.356	28%	0.282	S	S	.	.			trans	-79.5	85.2	175.6	57.9	0	0	0	0	111.6	C218 T219 G223 N224 F225	C218-T221 PolarHBondContact O-N 3.49Å; C218-T221 PolarHBondContact O-OG1 2.82Å; T219-T221 PolarHBondContact O-N 3.3Å; T221-G223 PolarHBondContact O-N 3.42Å; T221-N224 PolarHBondContact O-N 3.37Å; T221-F225 PolarHBondContact O-N 2.93Å
222	L	92.6	Very high	95.4	Very high	25 Å²	25	49.3 Å²	49.3	13%	0.131	28%	0.282	C	S	.	.	H	α-helix	trans	-48.7	-42.1	-175.3	-172.9	150.9	0	0	0	113.9	L96 K97 V198 A220 N224 F225 A226	L96-L222 HydrophobicContact CB-CD2 4.29Å; K97-L222 HydrophobicContact CB-CD1 3.82Å; K97-L222 HydrophobicContact CB-CD2 3.78Å; K97-L222 HydrophobicContact CB-CG 4.39Å; K97-L222 HydrophobicContact CD-CB 4.08Å; K97-L222 HydrophobicContact CD-CD1 3.71Å; K97-L222 HydrophobicContact CD-CD2 4.43Å; K97-L222 HydrophobicContact CD-CG 4.29Å; K97-L222 HydrophobicContact CG-CD1 4.38Å; V198-L222 HydrophobicContact CG1-CD2 4.43Å; V198-L222 HydrophobicContact CG1-CG 4.13Å; V198-L222 HydrophobicContact CG2-CD1 3.42Å; V198-L222 VanDerWaalsContact CG2-CD1 3.42Å; V198-L222 HydrophobicContact CG2-CG 3.82Å; A220-L222 PolarHBondContact O-N 3.3Å; L222-N224 VanDerWaalsContact C-N 3.35Å; L222-N224 PolarHBondContact O-N 3Å; L222-F225 PolarHBondContact O-N 2.85Å; L222-A226 WeakPolarHBondContact O-CB 3.35Å; L222-A226 PolarHBondContact O-N 3.08Å
223	G	93.3	Very high	95.3	Very high	9 Å²	9	44.7 Å²	44.7	9%	0.093	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-38.7	-178.8	0	0	0	0	0	113.9	F116 T221 K227	F116-G223 VanDerWaalsContact CZ-CA 3.47Å; T221-G223 PolarHBondContact O-N 3.42Å; G223-K227 VanDerWaalsContact O-CG 3.26Å; G223-K227 WeakPolarHBondContact O-CG 3.48Å; G223-K227 PolarHBondContact O-N 3.1Å
224	N	95.8	Very high	95.1	Very high	62 Å²	62	44.5 Å²	44.5	33%	0.332	26%	0.264	S	S	.	.	H	α-helix	trans	-77.7	-37.8	176.1	-66.5	-17.9	0	0	0	110.4	C177 V180 T221 L222 K227 A228	C177-N224 HydrophobicContact CB-CB 4.38Å; C177-N224 WeakPolarHBondContact CB-O 3.47Å; V180-N224 HydrophobicContact CG2-CB 4.18Å; T221-N224 PolarHBondContact O-N 3.37Å; L222-N224 VanDerWaalsContact C-N 3.35Å; L222-N224 PolarHBondContact O-N 3Å; N224-K227 PolarHBondContact O-N 3Å; N224-A228 WeakPolarHBondContact O-CB 3.36Å; N224-A228 PolarHBondContact O-N 3.32Å
225	F	96.6	Very high	95	Very high	16 Å²	16	44.9 Å²	44.9	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-44.3	179.1	-171.8	-142.7	0	0	0	112.8	V180 V182 A196 V198 P199 A215 T219 T221 L222 A228 T229	V180-F225 HydrophobicContact CG1-CB 4.47Å; V180-F225 HydrophobicContact CG1-CD2 3.78Å; V182-F225 HydrophobicContact CG2-CD2 3.73Å; V182-F225 HydrophobicContact CG2-CE2 3.65Å; A196-F225 HydrophobicContact CB-CE1 3.93Å; A196-F225 HydrophobicContact CB-CZ 4.08Å; V198-F225 HydrophobicContact CB-CD1 4.23Å; V198-F225 HydrophobicContact CB-CE1 4.44Å; V198-F225 HydrophobicContact CG1-CD1 4.45Å; P199-F225 HydrophobicContact CG-CD1 4.21Å; P199-F225 HydrophobicContact CG-CE1 3.43Å; P199-F225 VanDerWaalsContact CG-CE1 3.43Å; P199-F225 HydrophobicContact CG-CE2 3.8Å; P199-F225 HydrophobicContact CG-CZ 3.2Å; A215-F225 HydrophobicContact CB-CE2 3.67Å; A215-F225 HydrophobicContact CB-CZ 4.19Å; T219-F225 HydrophobicContact CG2-CD2 4.19Å; T219-F225 HydrophobicContact CG2-CE2 4.04Å; T221-F225 PolarHBondContact O-N 2.93Å; L222-F225 PolarHBondContact O-N 2.85Å; F225-A228 PolarHBondContact O-N 2.93Å; F225-T229 PolarHBondContact O-N 2.98Å; F225-T229 PolarHBondContact O-OG1 3.05Å
226	A	96.1	Very high	94.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-43.9	174.2	0	0	0	0	0	111.7	L96 L128 V198 L202 L222 T229 F230	L96-A226 HydrophobicContact CD1-CB 4.08Å; L128-A226 HydrophobicContact CD1-CB 4.46Å; L128-A226 HydrophobicContact CD2-CB 4.36Å; V198-A226 HydrophobicContact CG1-CB 3.96Å; L202-A226 HydrophobicContact CD1-CB 4.2Å; L202-A226 WeakPolarHBondContact CD1-O 3.35Å; L222-A226 WeakPolarHBondContact O-CB 3.35Å; L222-A226 PolarHBondContact O-N 3.08Å; A226-T229 PolarHBondContact O-N 2.83Å; A226-F230 WeakPolarHBondContact O-CB 3.34Å; A226-F230 PolarHBondContact O-N 2.81Å
227	K	96.6	Very high	94.7	Very high	86 Å²	86	38.8 Å²	38.8	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-63.9	-41.5	176.6	-76.3	179.6	174.8	-162.1	0	113.1	L128 C177 G223 N224 T229 F230 D231	L128-K227 HydrophobicContact CD2-CB 4.44Å; L128-K227 HydrophobicContact CD2-CG 3.81Å; C177-K227 HydrophobicContact CB-CB 3.94Å; G223-K227 VanDerWaalsContact O-CG 3.26Å; G223-K227 WeakPolarHBondContact O-CG 3.48Å; G223-K227 PolarHBondContact O-N 3.1Å; N224-K227 PolarHBondContact O-N 3Å; K227-T229 VanDerWaalsContact C-N 3.3Å; K227-T229 PolarHBondContact O-N 2.86Å; K227-F230 PolarHBondContact O-N 2.82Å; K227-D231 WeakPolarHBondContact O-CB 3.49Å; K227-D231 PolarHBondContact O-N 2.85Å
228	A	97.2	Very high	94.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-37.3	176.6	0	0	0	0	0	111.3	G175 C177 V180 V182 N224 F225 A232	G175-A228 WeakPolarHBondContact CA-O 3.39Å; C177-A228 HydrophobicContact CB-CB 3.83Å; V180-A228 HydrophobicContact CB-CB 4.42Å; V180-A228 HydrophobicContact CG1-CB 4.22Å; V182-A228 HydrophobicContact CB-CB 4.47Å; V182-A228 HydrophobicContact CG2-CB 3.83Å; N224-A228 WeakPolarHBondContact O-CB 3.36Å; N224-A228 PolarHBondContact O-N 3.32Å; F225-A228 PolarHBondContact O-N 2.93Å; A228-A232 PolarHBondContact O-N 2.96Å
229	T	96.6	Very high	94.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-47.5	174.1	-51.9	0	0	0	0	111	P199 L202 F225 A226 K227 D231 A232 I233	P199-T229 HydrophobicContact CB-CG2 3.62Å; P199-T229 WeakPolarHBondContact CB-OG1 3.46Å; L202-T229 HydrophobicContact CB-CG2 4.17Å; L202-T229 HydrophobicContact CD1-CG2 3.91Å; F225-T229 PolarHBondContact O-N 2.98Å; F225-T229 PolarHBondContact O-OG1 3.05Å; A226-T229 PolarHBondContact O-N 2.83Å; K227-T229 VanDerWaalsContact C-N 3.3Å; K227-T229 PolarHBondContact O-N 2.86Å; T229-D231 VanDerWaalsContact C-N 3.29Å; T229-D231 PolarHBondContact O-N 3.33Å; T229-A232 WeakPolarHBondContact O-CB 3.18Å; T229-A232 PolarHBondContact O-N 3.35Å; T229-A232 VanDerWaalsContact O-N 3.07Å; T229-I233 HydrophobicContact CG2-CD1 4.24Å; T229-I233 WeakPolarHBondContact O-CG1 3.31Å; T229-I233 PolarHBondContact O-N 2.89Å; T229-I233 VanDerWaalsContact O-N 3.07Å
230	F	96.6	Very high	94.2	Very high	34 Å²	34	46.9 Å²	46.9	15%	0.149	25%	0.249	C	C	.	.	H	α-helix	trans	-59.3	-40.3	177.4	-177.6	-97.3	0	0	0	112.1	V126 L128 S150 V152 A226 K227 A232 I233 S234	V126-F230 HydrophobicContact CG1-CD2 4.18Å; V126-F230 HydrophobicContact CG1-CE2 4.02Å; V126-F230 WeakPolarHBondContact O-CE2 3.44Å; L128-F230 HydrophobicContact CB-CB 4.35Å; L128-F230 HydrophobicContact CB-CD1 4.42Å; L128-F230 HydrophobicContact CB-CD2 3.72Å; L128-F230 HydrophobicContact CB-CE2 4.12Å; L128-F230 HydrophobicContact CB-CG 3.89Å; L128-F230 HydrophobicContact CD2-CB 3.97Å; L128-F230 HydrophobicContact CD2-CG 4.31Å; S150-F230 VanDerWaalsContact O-CZ 3.28Å; S150-F230 WeakPolarHBondContact O-CZ 3.48Å; V152-F230 HydrophobicContact CB-CZ 4.21Å; V152-F230 HydrophobicContact CG2-CE1 4.39Å; V152-F230 HydrophobicContact CG2-CZ 3.78Å; A226-F230 WeakPolarHBondContact O-CB 3.34Å; A226-F230 PolarHBondContact O-N 2.81Å; K227-F230 PolarHBondContact O-N 2.82Å; F230-A232 VanDerWaalsContact C-N 3.34Å; F230-A232 PolarHBondContact O-N 2.92Å; F230-I233 PolarHBondContact O-N 2.78Å; F230-S234 PolarHBondContact O-N 3.44Å; F230-S234 PolarHBondContact O-OG 2.86Å
231	D	96.6	Very high	94	Very high	42 Å²	42	43.5 Å²	43.5	23%	0.225	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-34	173.9	-179.7	60	0	0	0	113	G175 R176 K227 T229 I233 S234 K235	G175-D231 WeakPolarHBondContact CA-OD2 3.36Å; R176-D231 PolarHBondContact N-OD2 3.19Å; K227-D231 WeakPolarHBondContact O-CB 3.49Å; K227-D231 PolarHBondContact O-N 2.85Å; T229-D231 VanDerWaalsContact C-N 3.29Å; T229-D231 PolarHBondContact O-N 3.33Å; D231-I233 VanDerWaalsContact C-N 3.33Å; D231-S234 WeakPolarHBondContact CA-OG 3.48Å; D231-S234 PolarHBondContact O-OG 3.07Å; D231-K235 WeakPolarHBondContact O-CB 3.42Å; D231-K235 WeakPolarHBondContact O-CD 3.37Å; D231-K235 VanDerWaalsContact O-CG 3.26Å; D231-K235 WeakPolarHBondContact O-CG 3.41Å; D231-K235 PolarHBondContact O-N 3.08Å; D231-K235 VanDerWaalsContact OD1-CE 3.28Å; D231-K235 WeakPolarHBondContact OD1-CE 3.28Å; D231-K235 IonicContact OD1-NZ 2.79Å; D231-K235 PolarHBondContact OD1-NZ 2.98Å; D231-K235 WeakPolarHBondContact OD2-CE 3.44Å; D231-K235 IonicContact OD2-NZ 3.98Å; D231-K235 PolarHBondContact OD2-NZ 3.2Å
232	A	96.1	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66	-40	173.4	0	0	0	0	0	111.1	V173 L184 A228 T229 F230	V173-A232 HydrophobicContact CG2-CB 4.44Å; V173-A232 WeakPolarHBondContact CG2-O 3.32Å; L184-A232 HydrophobicContact CD1-CB 3.89Å; L184-A232 HydrophobicContact CG-CB 3.96Å; A228-A232 PolarHBondContact O-N 2.96Å; T229-A232 WeakPolarHBondContact O-CB 3.18Å; T229-A232 PolarHBondContact O-N 3.35Å; T229-A232 VanDerWaalsContact O-N 3.07Å; F230-A232 VanDerWaalsContact C-N 3.34Å; F230-A232 PolarHBondContact O-N 2.92Å
233	I	94.8	Very high	93.7	Very high	1 Å²	1	48 Å²	48	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-45.4	179.5	-66.2	168.7	0	0	0	111.1	V126 V154 L184 L202 L203 A206 T229 F230 D231 K235 T236	V126-I233 HydrophobicContact CG1-CD1 4.32Å; V126-I233 HydrophobicContact CG1-CG2 3.73Å; V154-I233 HydrophobicContact CB-CG2 3.99Å; V154-I233 HydrophobicContact CG1-CG2 3.67Å; V154-I233 HydrophobicContact CG2-CG2 3.25Å; L184-I233 HydrophobicContact CD1-CG1 4.04Å; L202-I233 HydrophobicContact CB-CD1 4.33Å; L203-I233 HydrophobicContact CD2-CD1 4.09Å; L203-I233 HydrophobicContact CD2-CG1 4.2Å; A206-I233 HydrophobicContact CB-CD1 4.38Å; T229-I233 HydrophobicContact CG2-CD1 4.24Å; T229-I233 WeakPolarHBondContact O-CG1 3.31Å; T229-I233 PolarHBondContact O-N 2.89Å; T229-I233 VanDerWaalsContact O-N 3.07Å; F230-I233 PolarHBondContact O-N 2.78Å; D231-I233 VanDerWaalsContact C-N 3.33Å; I233-K235 PolarHBondContact O-N 3.18Å; I233-T236 VanDerWaalsContact O-CB 3.31Å; I233-T236 WeakPolarHBondContact O-CB 3.44Å; I233-T236 WeakPolarHBondContact O-CG2 3.26Å; I233-T236 PolarHBondContact O-N 2.97Å; I233-T236 VanDerWaalsContact O-N 3.1Å; I233-T236 PolarHBondContact O-OG1 3.3Å
234	S	93.8	Very high	93.6	Very high	31 Å²	31	51.4 Å²	51.4	22%	0.217	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-34.4	179.4	62.7	0	0	0	0	112.6	F230 D231 T236	F230-S234 PolarHBondContact O-N 3.44Å; F230-S234 PolarHBondContact O-OG 2.86Å; D231-S234 WeakPolarHBondContact CA-OG 3.48Å; D231-S234 PolarHBondContact O-OG 3.07Å; S234-T236 PolarHBondContact O-N 3.09Å
235	K	94.6	Very high	93.4	Very high	74 Å²	74	56.8 Å²	56.8	32%	0.322	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-7.6	177.7	-73.8	170.6	178.1	166.9	0	114.6	T174 D231 I233 Y237 S238 Y239	T174-K235 WeakPolarHBondContact O-CD 3.49Å; D231-K235 WeakPolarHBondContact O-CB 3.42Å; D231-K235 WeakPolarHBondContact O-CD 3.37Å; D231-K235 VanDerWaalsContact O-CG 3.26Å; D231-K235 WeakPolarHBondContact O-CG 3.41Å; D231-K235 PolarHBondContact O-N 3.08Å; D231-K235 VanDerWaalsContact OD1-CE 3.28Å; D231-K235 WeakPolarHBondContact OD1-CE 3.28Å; D231-K235 IonicContact OD1-NZ 2.79Å; D231-K235 PolarHBondContact OD1-NZ 2.98Å; D231-K235 WeakPolarHBondContact OD2-CE 3.44Å; D231-K235 IonicContact OD2-NZ 3.98Å; D231-K235 PolarHBondContact OD2-NZ 3.2Å; I233-K235 PolarHBondContact O-N 3.18Å; K235-Y237 VanDerWaalsContact C-N 3.27Å; K235-Y237 PolarHBondContact O-N 2.99Å; K235-S238 WeakPolarHBondContact O-CB 3.4Å; K235-S238 PolarHBondContact O-N 3.39Å; K235-Y239 PolarHBondContact O-N 3.07Å
236	T	93.2	Very high	93.2	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-34.9	178.1	58.5	0	0	0	0	112.8	R155 V173 I233 S234	R155-T236 PolarHBondContact N-OG1 3.28Å; R155-T236 VanDerWaalsContact N-OG1 3.1Å; V173-T236 HydrophobicContact CG1-CG2 4.4Å; V173-T236 HydrophobicContact CG2-CG2 4.09Å; I233-T236 VanDerWaalsContact O-CB 3.31Å; I233-T236 WeakPolarHBondContact O-CB 3.44Å; I233-T236 WeakPolarHBondContact O-CG2 3.26Å; I233-T236 PolarHBondContact O-N 2.97Å; I233-T236 VanDerWaalsContact O-N 3.1Å; I233-T236 PolarHBondContact O-OG1 3.3Å; S234-T236 PolarHBondContact O-N 3.09Å
237	Y	91.6	Very high	93	Very high	121 Å²	121	73.6 Å²	73.6	48%	0.475	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.9	172.1	-82.3	-73.4	0	0	0	113.6	P153 R155 K235 Y239	P153-Y237 HydrophobicContact CB-CD2 4.28Å; P153-Y237 HydrophobicContact CB-CE2 3.75Å; P153-Y237 HydrophobicContact CG-CD2 4.12Å; P153-Y237 HydrophobicContact CG-CE2 4.06Å; P153-Y237 WeakPolarHBondContact O-CD2 3.4Å; R155-Y237 HydrophobicContact CB-CD1 3.94Å; R155-Y237 HydrophobicContact CB-CD2 3.77Å; R155-Y237 HydrophobicContact CB-CE1 3.74Å; R155-Y237 HydrophobicContact CB-CE2 3.59Å; R155-Y237 HydrophobicContact CB-CG 3.93Å; R155-Y237 HydrophobicContact CG-CD1 4.18Å; R155-Y237 HydrophobicContact CG-CE1 3.8Å; R155-Y237 HydrophobicContact CG-CE2 4.48Å; K235-Y237 VanDerWaalsContact C-N 3.27Å; K235-Y237 PolarHBondContact O-N 2.99Å; Y237-Y239 PolarHBondContact O-N 3.04Å
238	S	90.5	Very high	92.8	Very high	96 Å²	96	73.8 Å²	73.8	67%	0.671	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.5	177	-51.3	0	0	0	0	113.1	K235	K235-S238 WeakPolarHBondContact O-CB 3.4Å; K235-S238 PolarHBondContact O-N 3.39Å
239	Y	89	Confident	92.6	Very high	130 Å²	130	80.1 Å²	80.1	51%	0.51	40%	0.401	S	S	.	.	S	Bend	trans	-85.1	117.9	178.9	-156.7	-92.2	0	0	0	111	R155 C171 K235 Y237 T241	R155-Y239 PolarHBondContact NH1-O 2.61Å; C171-Y239 HydrophobicContact CB-CD1 4.08Å; C171-Y239 HydrophobicContact CB-CE1 4.25Å; C171-Y239 WeakPolarHBondContact SG-CD1 3.37Å; C171-Y239 VanDerWaalsContact SG-CG 3.52Å; K235-Y239 PolarHBondContact O-N 3.07Å; Y237-Y239 PolarHBondContact O-N 3.04Å; Y239-T241 HydrophobicContact CD1-CG2 3.85Å; Y239-T241 HydrophobicContact CE1-CG2 4.38Å
240	L	90	Very high	92.4	Very high	112 Å²	112	89 Å²	89	59%	0.586	44%	0.44	S	S	*	.			trans	-79	126.9	176.4	-174	66.4	0	0	0	110	L244	L240-L244 HydrophobicContact CD1-CB 3.94Å
241	T	89.6	Confident	92.2	Very high	16 Å²	16	91.6 Å²	91.6	10%	0.098	46%	0.459	C	S	.	.			trans	-122.7	155.2	-179.4	47.6	0	0	0	0	109.7	R155 Y239 D243 L244 W245	R155-T241 VanDerWaalsContact CZ-OG1 3.3Å; R155-T241 PolarHBondContact NH1-OG1 3.31Å; R155-T241 PolarHBondContact NH2-OG1 2.65Å; Y239-T241 HydrophobicContact CD1-CG2 3.85Å; Y239-T241 HydrophobicContact CE1-CG2 4.38Å; T241-D243 WeakPolarHBondContact CB-OD1 3.38Å; T241-D243 PolarHBondContact O-N 3.49Å; T241-D243 VanDerWaalsContact O-N 3.09Å; T241-D243 PolarHBondContact OG1-OD1 3.5Å; T241-L244 WeakPolarHBondContact O-CA 3.31Å; T241-L244 PolarHBondContact O-N 3.38Å; T241-W245 VanDerWaalsContact O-CD1 3.25Å
242	P	91.1	Very high	92	Very high	90 Å²	90	96.8 Å²	96.8	58%	0.584	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-57.2	-27.2	-174.6	-28.6	36.1	0	0	0	115.9	L244 W245	P242-L244 PolarHBondContact O-N 2.88Å; P242-W245 HydrophobicContact CB-CD2 4.14Å; P242-W245 HydrophobicContact CB-CE3 4.23Å; P242-W245 HydrophobicContact CB-CH2 4.49Å; P242-W245 HydrophobicContact CB-CZ2 4.4Å; P242-W245 HydrophobicContact CB-CZ3 4.4Å; P242-W245 HydrophobicContact CG-CH2 4.17Å; P242-W245 HydrophobicContact CG-CZ2 3.95Å; P242-W245 WeakPolarHBondContact O-CB 3.34Å; P242-W245 PolarHBondContact O-N 3.26Å
243	D	88.4	Confident	91.8	Very high	87 Å²	87	97.8 Å²	97.8	47%	0.465	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-66.1	-20	173.8	61.1	-35.8	0	0	0	113.8	R155 T241	R155-D243 VanDerWaalsContact NH2-CG 3.3Å; R155-D243 IonicContact NH2-OD1 3.69Å; R155-D243 PolarHBondContact NH2-OD1 2.98Å; R155-D243 VanDerWaalsContact NH2-OD1 3.12Å; R155-D243 IonicContact NH2-OD2 3.58Å; R155-D243 PolarHBondContact NH2-OD2 2.95Å; T241-D243 WeakPolarHBondContact CB-OD1 3.38Å; T241-D243 PolarHBondContact O-N 3.49Å; T241-D243 VanDerWaalsContact O-N 3.09Å; T241-D243 PolarHBondContact OG1-OD1 3.5Å
244	L	90.2	Very high	91.7	Very high	81 Å²	81	98 Å²	98	42%	0.424	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-102.6	5.9	177	-62.3	179.7	0	0	0	113.2	R155 L240 T241 P242 K246	R155-L244 VanDerWaalsContact NH1-CD1 3.31Å; L240-L244 HydrophobicContact CD1-CB 3.94Å; T241-L244 WeakPolarHBondContact O-CA 3.31Å; T241-L244 PolarHBondContact O-N 3.38Å; P242-L244 PolarHBondContact O-N 2.88Å; L244-K246 PolarHBondContact O-N 2.87Å
245	W	93	Very high	91.7	Very high	176 Å²	176	100.1 Å²	100.1	67%	0.667	49%	0.492	S	S	*	.			trans	-75.8	-10.1	179.2	-70.5	-0.4	0	0	0	114	T241 P242 E247	T241-W245 VanDerWaalsContact O-CD1 3.25Å; P242-W245 HydrophobicContact CB-CD2 4.14Å; P242-W245 HydrophobicContact CB-CE3 4.23Å; P242-W245 HydrophobicContact CB-CH2 4.49Å; P242-W245 HydrophobicContact CB-CZ2 4.4Å; P242-W245 HydrophobicContact CB-CZ3 4.4Å; P242-W245 HydrophobicContact CG-CH2 4.17Å; P242-W245 HydrophobicContact CG-CZ2 3.95Å; P242-W245 WeakPolarHBondContact O-CB 3.34Å; P242-W245 PolarHBondContact O-N 3.26Å; W245-E247 PolarHBondContact O-N 2.91Å
246	K	92.8	Very high	91.6	Very high	174 Å²	174	102.8 Å²	102.8	76%	0.757	51%	0.505	S	S	*	.	S	Bend	trans	-61.1	136.7	175.4	-65.6	-175.7	179.2	-176	0	109.4	L244 T248	L244-K246 PolarHBondContact O-N 2.87Å; K246-T248 PolarHBondContact O-N 3.49Å
247	E	91.8	Very high	91.5	Very high	194 Å²	194	108.5 Å²	108.5	91%	0.907	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-58.8	129.6	178	-166.3	172.1	-170.4	0	0	110.1	W245	W245-E247 PolarHBondContact O-N 2.91Å
248	T	91.9	Very high	91.6	Very high	91 Å²	91	104.6 Å²	104.6	56%	0.558	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-90	132.4	-177.1	55.1	0	0	0	0	110	K246 F250	K246-T248 PolarHBondContact O-N 3.49Å; T248-F250 PolarHBondContact O-N 3.22Å
249	V	92.8	Very high	91.6	Very high	132 Å²	132	103.6 Å²	103.6	80%	0.8	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-78.6	122.3	171.1	-178.4	0	0	0	0	109.2	T251	V249-T251 PolarHBondContact O-N 3.4Å
250	F	91.5	Very high	91.7	Very high	187 Å²	187	103.2 Å²	103.2	82%	0.82	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-76	117.5	175.6	-63.2	-68.6	0	0	0	110.6	T248	T248-F250 PolarHBondContact O-N 3.22Å
251	T	92.7	Very high	91.7	Very high	89 Å²	89	100.1 Å²	100.1	55%	0.546	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-90.7	164	171.3	45.5	0	0	0	0	110.7	Y73 V249	Y73-T251 VanDerWaalsContact OH-CB 3.31Å; Y73-T251 WeakPolarHBondContact OH-CB 3.27Å; Y73-T251 PolarHBondContact OH-O 3.36Å; Y73-T251 PolarHBondContact OH-OG1 2.87Å; V249-T251 PolarHBondContact O-N 3.4Å
252	K	92.7	Very high	91.6	Very high	150 Å²	150	99.9 Å²	99.9	65%	0.652	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-74.1	136.1	179.4	-67.6	-178.9	-178.3	177	0	110.3	Y73	Y73-K252 PolarHBondContact OH-N 2.97Å; Y73-K252 PolarHBondContact OH-O 2.79Å
253	S	92.7	Very high	91.5	Very high	22 Å²	22	98.6 Å²	98.6	15%	0.154	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-59.2	143.9	176	176.7	0	0	0	0	111.4	Y255 Q256 E257	S253-Y255 PolarHBondContact O-N 2.84Å; S253-Y255 PolarHBondContact OG-N 2.86Å; S253-Q256 WeakPolarHBondContact O-CA 3.24Å; S253-Q256 WeakPolarHBondContact O-CB 3.41Å; S253-Q256 PolarHBondContact O-N 2.86Å; S253-E257 PolarHBondContact O-N 2.89Å
254	P	92.9	Very high	91.3	Very high	5 Å²	5	101.7 Å²	101.7	3%	0.032	50%	0.501	C	S	.	.	H	α-helix	trans	-53.9	-30.8	175.4	-28.7	33.8	0	0	0	113.1	L58 I64 Y73 F258	L58-P254 HydrophobicContact CD1-CB 4.34Å; I64-P254 HydrophobicContact CD1-CB 4.09Å; I64-P254 HydrophobicContact CG1-CB 4.2Å; Y73-P254 HydrophobicContact CD2-CG 3.9Å; Y73-P254 HydrophobicContact CE2-CG 4.11Å; P254-F258 HydrophobicContact CB-CD2 4.37Å; P254-F258 WeakPolarHBondContact O-CB 3.25Å; P254-F258 VanDerWaalsContact O-CD2 3.29Å; P254-F258 WeakPolarHBondContact O-CD2 3.27Å; P254-F258 PolarHBondContact O-N 2.99Å
255	Y	92.3	Very high	90.7	Very high	75 Å²	75	100.3 Å²	100.3	29%	0.294	50%	0.496	S	S	.	.	H	α-helix	trans	-70.4	-33.9	175.8	-65.7	-33.8	0	0	0	113.2	K54 L58 L75 S253 T259 L262	K54-Y255 HydrophobicContact CB-CE1 3.99Å; L58-Y255 HydrophobicContact CD1-CD1 3.96Å; L58-Y255 HydrophobicContact CD1-CE1 4.17Å; L75-Y255 HydrophobicContact CD1-CE2 4.23Å; L75-Y255 HydrophobicContact CD2-CD2 4.15Å; L75-Y255 HydrophobicContact CD2-CE2 3.57Å; L75-Y255 HydrophobicContact CG-CE2 4.49Å; S253-Y255 PolarHBondContact O-N 2.84Å; S253-Y255 PolarHBondContact OG-N 2.86Å; Y255-T259 PolarHBondContact O-N 3.41Å; Y255-T259 PolarHBondContact O-OG1 3.07Å; Y255-L262 HydrophobicContact CD1-CD1 4.19Å
256	Q	92.3	Very high	89.3	Confident	131 Å²	131	96.6 Å²	96.6	61%	0.612	49%	0.486	S	S	*	.	H	α-helix	trans	-75.4	-46.9	175.7	-68.9	175	-19.7	0	0	110.6	S253 F258 T259	S253-Q256 WeakPolarHBondContact O-CA 3.24Å; S253-Q256 WeakPolarHBondContact O-CB 3.41Å; S253-Q256 PolarHBondContact O-N 2.86Å; Q256-F258 PolarHBondContact O-N 3.27Å; Q256-T259 PolarHBondContact O-N 3.01Å; Q256-T259 PolarHBondContact O-OG1 3.04Å
257	E	92.5	Very high	87.4	Confident	119 Å²	119	91.1 Å²	91.1	56%	0.556	47%	0.467	S	S	*	.	H	α-helix	trans	-62.7	-42	-178.2	-171.9	175.7	174.7	0	0	112.4	S253	S253-E257 PolarHBondContact O-N 2.89Å
258	F	92.9	Very high	85.7	Confident	39 Å²	39	91.5 Å²	91.5	17%	0.171	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	27.4	-177.6	-56	-63	0	0	0	113.4	L58 K63 P254 Q256 D260 H261 L262	L58-F258 HydrophobicContact CD1-CD2 4.48Å; L58-F258 HydrophobicContact CD2-CB 3.5Å; L58-F258 VanDerWaalsContact CD2-CB 3.5Å; L58-F258 HydrophobicContact CD2-CD2 4.15Å; L58-F258 HydrophobicContact CD2-CG 4.02Å; K63-F258 HydrophobicContact CB-CD1 4.17Å; K63-F258 HydrophobicContact CB-CD2 3.95Å; K63-F258 HydrophobicContact CB-CE1 4.1Å; K63-F258 HydrophobicContact CB-CE2 3.89Å; K63-F258 HydrophobicContact CB-CG 4.1Å; K63-F258 HydrophobicContact CB-CZ 3.97Å; K63-F258 HydrophobicContact CD-CD1 4.08Å; K63-F258 HydrophobicContact CD-CE1 3.97Å; K63-F258 HydrophobicContact CG-CD1 4.23Å; K63-F258 HydrophobicContact CG-CE1 4.39Å; K63-F258 HydrophobicContact CG-CG 4.42Å; K63-F258 WeakPolarHBondContact O-CZ 3.36Å; P254-F258 HydrophobicContact CB-CD2 4.37Å; P254-F258 WeakPolarHBondContact O-CB 3.25Å; P254-F258 VanDerWaalsContact O-CD2 3.29Å; P254-F258 WeakPolarHBondContact O-CD2 3.27Å; P254-F258 PolarHBondContact O-N 2.99Å; Q256-F258 PolarHBondContact O-N 3.27Å; F258-D260 PolarHBondContact O-N 2.84Å; F258-H261 HydrophobicContact CB-CB 4.3Å; F258-H261 PolarHBondContact O-N 3.29Å; F258-L262 WeakPolarHBondContact O-CG 3.3Å; F258-L262 PolarHBondContact O-N 3.35Å
259	T	91.6	Very high	83.7	Confident	75 Å²	75	92.4 Å²	92.4	46%	0.46	47%	0.465	S	S	.	.	H	α-helix	trans	-57.2	-46.9	178.5	-71.5	0	0	0	0	111.9	Y255 Q256 H261 L262 A263	Y255-T259 PolarHBondContact O-N 3.41Å; Y255-T259 PolarHBondContact O-OG1 3.07Å; Q256-T259 PolarHBondContact O-N 3.01Å; Q256-T259 PolarHBondContact O-OG1 3.04Å; T259-H261 VanDerWaalsContact C-N 3.31Å; T259-H261 PolarHBondContact O-N 3.26Å; T259-L262 PolarHBondContact O-N 3.43Å; T259-A263 PolarHBondContact O-N 2.88Å
260	D	90.5	Very high	81.2	Confident	123 Å²	123	89.8 Å²	89.8	66%	0.658	45%	0.453	S	S	*	.	H	α-helix	trans	-65	-37.1	-178.4	-61.1	-29.5	0	0	0	112.4	F258 A263 K264	F258-D260 PolarHBondContact O-N 2.84Å; D260-A263 PolarHBondContact O-N 3.42Å; D260-K264 WeakPolarHBondContact O-CG 3.48Å; D260-K264 PolarHBondContact O-N 2.84Å
261	H	89.8	Confident	79	Confident	46 Å²	46	84.4 Å²	84.4	21%	0.213	44%	0.435	C	S	.	.	H	α-helix	trans	-67.1	-43.6	176.4	-177.8	-94.3	0	0	0	111.1	D61 F258 T259 A263 K264 T265	D61-H261 IonicContact OD2-CE1 3.22Å; D61-H261 PolarHBondContact OD2-CE1 2.77Å; D61-H261 IonicContact OD2-NE2 3.98Å; F258-H261 HydrophobicContact CB-CB 4.3Å; F258-H261 PolarHBondContact O-N 3.29Å; T259-H261 VanDerWaalsContact C-N 3.31Å; T259-H261 PolarHBondContact O-N 3.26Å; H261-A263 VanDerWaalsContact C-N 3.33Å; H261-A263 PolarHBondContact O-N 3.02Å; H261-K264 PolarHBondContact O-N 3.01Å; H261-T265 WeakPolarHBondContact O-CG2 2.99Å; H261-T265 PolarHBondContact O-N 3.34Å; H261-T265 VanDerWaalsContact O-N 3.11Å; H261-T265 PolarHBondContact O-OG1 3.22Å
262	L	88.3	Confident	76.7	Confident	12 Å²	12	84.8 Å²	84.8	6%	0.063	43%	0.431	C	S	.	.	H	α-helix	trans	-62.8	-40.3	173.5	-74.6	174.2	0	0	0	111.1	K54 L58 Y255 F258 T259 K264 T265 H266	K54-L262 HydrophobicContact CB-CD1 4.17Å; K54-L262 HydrophobicContact CB-CD2 4.02Å; K54-L262 HydrophobicContact CD-CD1 4.31Å; K54-L262 HydrophobicContact CG-CD1 4.45Å; K54-L262 HydrophobicContact CG-CD2 4.34Å; L58-L262 HydrophobicContact CD1-CD1 4.22Å; L58-L262 HydrophobicContact CD2-CD1 4.46Å; L58-L262 HydrophobicContact CD2-CD2 4.04Å; L58-L262 HydrophobicContact CD2-CG 4.02Å; L58-L262 HydrophobicContact CG-CD1 4.46Å; L58-L262 HydrophobicContact CG-CD2 4.06Å; L58-L262 HydrophobicContact CG-CG 4.35Å; Y255-L262 HydrophobicContact CD1-CD1 4.19Å; F258-L262 WeakPolarHBondContact O-CG 3.3Å; F258-L262 PolarHBondContact O-N 3.35Å; T259-L262 PolarHBondContact O-N 3.43Å; L262-K264 VanDerWaalsContact C-N 3.28Å; L262-K264 PolarHBondContact O-N 3.45Å; L262-T265 WeakPolarHBondContact CA-OG1 3.18Å; L262-T265 PolarHBondContact O-N 3.36Å; L262-T265 PolarHBondContact O-OG1 3.2Å; L262-H266 WeakPolarHBondContact O-CA 3.37Å; L262-H266 WeakPolarHBondContact O-CB 3.41Å; L262-H266 PolarHBondContact O-N 3.2Å
263	A	87.3	Confident	74.3	Confident	62 Å²	62	87.4 Å²	87.4	51%	0.512	44%	0.437	S	S	.	.	H	α-helix	trans	-57.7	-41.6	177.3	0	0	0	0	0	112.1	T259 D260 H261 T267	T259-A263 PolarHBondContact O-N 2.88Å; D260-A263 PolarHBondContact O-N 3.42Å; H261-A263 VanDerWaalsContact C-N 3.33Å; H261-A263 PolarHBondContact O-N 3.02Å; A263-T267 PolarHBondContact O-OG1 3.21Å
264	K	85.3	Confident	71.9	Confident	152 Å²	152	91 Å²	91	66%	0.661	46%	0.457	S	S	*	.	H	α-helix	trans	-69.5	-35.6	178.5	-67.8	172.6	-175.8	179	0	113.7	D260 H261 L262 T267 Q272	D260-K264 WeakPolarHBondContact O-CG 3.48Å; D260-K264 PolarHBondContact O-N 2.84Å; H261-K264 PolarHBondContact O-N 3.01Å; L262-K264 VanDerWaalsContact C-N 3.28Å; L262-K264 PolarHBondContact O-N 3.45Å; K264-T267 PolarHBondContact O-OG1 3.02Å; K264-Q272 PolarHBondContact O-NE2 2.98Å; K264-Q272 VanDerWaalsContact O-NE2 3.08Å
265	T	76.5	Confident	69.6	Low	53 Å²	53	94.5 Å²	94.5	33%	0.325	49%	0.487	S	S	.	.	H	α-helix	trans	-97.1	-20.1	-174.4	54.3	0	0	0	0	113.9	H261 L262	H261-T265 WeakPolarHBondContact O-CG2 2.99Å; H261-T265 PolarHBondContact O-N 3.34Å; H261-T265 VanDerWaalsContact O-N 3.11Å; H261-T265 PolarHBondContact O-OG1 3.22Å; L262-T265 WeakPolarHBondContact CA-OG1 3.18Å; L262-T265 PolarHBondContact O-N 3.36Å; L262-T265 PolarHBondContact O-OG1 3.2Å
266	H	65.1	Low	67.5	Low	98 Å²	98	95.2 Å²	95.2	45%	0.454	51%	0.508	S	S	.	.	H	α-helix	trans	-86.7	-25.2	-177.4	-176	-88.9	0	0	0	112.7	L262 R268	L262-H266 WeakPolarHBondContact O-CA 3.37Å; L262-H266 WeakPolarHBondContact O-CB 3.41Å; L262-H266 PolarHBondContact O-N 3.2Å; H266-R268 PolarHBondContact O-N 2.63Å
267	T	52.5	Low	65.2	Low	58 Å²	58	92.2 Å²	92.2	36%	0.356	51%	0.506	S	S	.	.	S	Bend	trans	-61.6	124.3	172.8	36.1	0	0	0	0	109.8	A263 K264 V269	A263-T267 PolarHBondContact O-OG1 3.21Å; K264-T267 PolarHBondContact O-OG1 3.02Å; T267-V269 PolarHBondContact O-N 3.35Å
268	R	54.7	Low	63.1	Low	202 Å²	202	92.2 Å²	92.2	76%	0.762	51%	0.514	S	S	*	.			trans	-49	133.7	171.5	-70.4	-179	176	175.3	-0.5	108.2	H266 S270 V271	H266-R268 PolarHBondContact O-N 2.63Å; R268-S270 WeakPolarHBondContact CB-OG 3.4Å; R268-S270 PolarHBondContact O-N 3.17Å; R268-V271 PolarHBondContact O-N 2.98Å
269	V	50.4	Low	60.9	Low	111 Å²	111	95.5 Å²	95.5	67%	0.673	54%	0.539	S	S	*	.	H	α-helix	trans	-47.6	-24.1	174.9	-179.7	0	0	0	0	112.3	T267 V271	T267-V269 PolarHBondContact O-N 3.35Å; V269-V271 PolarHBondContact O-N 3.14Å
270	S	41.3	Very low	58.7	Low	76 Å²	76	97 Å²	97	53%	0.531	56%	0.559	S	S	.	*	H	α-helix	trans	-64.7	-29.7	173.2	62.2	0	0	0	0	115.2	R268	R268-S270 WeakPolarHBondContact CB-OG 3.4Å; R268-S270 PolarHBondContact O-N 3.17Å
271	V	44.9	Very low	56.7	Low	75 Å²	75	96 Å²	96	46%	0.455	56%	0.562	S	S	.	*	H	α-helix	trans	-84.2	-28.1	-178.8	-178	0	0	0	0	111.7	R268 V269 R273 T274 A275	R268-V271 PolarHBondContact O-N 2.98Å; V269-V271 PolarHBondContact O-N 3.14Å; V271-R273 VanDerWaalsContact C-N 3.31Å; V271-R273 PolarHBondContact O-N 3.45Å; V271-T274 PolarHBondContact O-N 2.67Å; V271-T274 PolarHBondContact O-OG1 3.35Å; V271-A275 PolarHBondContact O-N 2.85Å
272	Q	43.5	Very low	54.3	Low	96 Å²	96	103.2 Å²	103.2	45%	0.449	62%	0.617	S	S	.	*	H	α-helix	trans	-68.2	-31.2	176	-76.3	171.2	-19.3	0	0	112.2	K264 A275 A276	K264-Q272 PolarHBondContact O-NE2 2.98Å; K264-Q272 VanDerWaalsContact O-NE2 3.08Å; Q272-A275 PolarHBondContact O-N 2.78Å; Q272-A276 PolarHBondContact O-N 3.42Å
273	R	43.6	Very low	52.6	Low	206 Å²	206	107.8 Å²	107.8	78%	0.777	65%	0.645	S	S	*	*	H	α-helix	trans	-66.4	-34.6	173.4	-81	-173.9	172.2	-179	-2.6	113.4	V271 A277	V271-R273 VanDerWaalsContact C-N 3.31Å; V271-R273 PolarHBondContact O-N 3.45Å; R273-A277 WeakPolarHBondContact O-CB 3.42Å
274	T	42.4	Very low	50.8	Low	96 Å²	96	110.2 Å²	110.2	59%	0.589	65%	0.652	S	S	*	*	H	α-helix	trans	-77.1	-28.3	177.7	39.3	0	0	0	0	113	V271	V271-T274 PolarHBondContact O-N 2.67Å; V271-T274 PolarHBondContact O-OG1 3.35Å
275	A	44.5	Very low	48.9	Very low	80 Å²	80	107.8 Å²	107.8	66%	0.661	65%	0.651	S	S	*	*	H	α-helix	trans	-77.6	-30.8	177.7	0	0	0	0	0	113.3	V271 Q272 A277	V271-A275 PolarHBondContact O-N 2.85Å; Q272-A275 PolarHBondContact O-N 2.78Å; A275-A277 VanDerWaalsContact C-N 3.3Å
276	A	46.9	Very low	47.3	Very low	89 Å²	89	111.1 Å²	111.1	74%	0.736	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-8.9	176.2	0	0	0	0	0	113.9	Q272	Q272-A276 PolarHBondContact O-N 3.42Å
277	A	43.6	Very low	46.1	Very low	68 Å²	68	111.9 Å²	111.9	56%	0.562	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	11.3	-173.2	0	0	0	0	0	114.5	R273 A275 P279	R273-A277 WeakPolarHBondContact O-CB 3.42Å; A275-A277 VanDerWaalsContact C-N 3.3Å; A277-P279 VanDerWaalsContact C-CD 3.41Å; A277-P279 WeakPolarHBondContact O-CD 3.25Å
278	V	50	Low	45.7	Very low	120 Å²	120	115.5 Å²	115.5	73%	0.727	71%	0.706	S	S	*	*			trans	-102.5	87.5	170	-171.4	0	0	0	0	108.5	A280	V278-A280 PolarHBondContact O-N 2.73Å
279	P	46.4	Very low	45.1	Very low	107 Å²	107	109.3 Å²	109.3	70%	0.695	70%	0.702	S	S	*	*			trans	-65.6	125.2	160.2	28.3	-29.8	0	0	0	107.4	A277 S281	A277-P279 VanDerWaalsContact C-CD 3.41Å; A277-P279 WeakPolarHBondContact O-CD 3.25Å; P279-S281 PolarHBondContact O-N 3.29Å
280	A	45.7	Very low	44.7	Very low	106 Å²	106	109.2 Å²	109.2	88%	0.876	70%	0.704	S	S	*	*			trans	-61.6	103.8	169	0	0	0	0	0	108.3	V278	V278-A280 PolarHBondContact O-N 2.73Å
281	S	47	Very low	45	Very low	103 Å²	103	111.9 Å²	111.9	72%	0.72	72%	0.719	S	S	*	*			trans	-90	137.6	162.4	56.1	0	0	0	0	108.7	P279	P279-S281 PolarHBondContact O-N 3.29Å
282	S	40.9	Very low	45	Very low	197 Å²	197	115.3 Å²	115.3	100%	1.378	74%	0.743	S	S	*	*			trans	71.9	0	-179.2	54	0	0	0	0	117.4

Retrieved 282 of 282 residues in 668.8 ms (Link to these results)

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