A0A087XR99_POEFO Loading...

Fibroblast growth factor

AlphaFold DB , UniProt , Accession A0A087XR99, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 239 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	39.6	Very low	47	Very low	231 Å²	231	146.1 Å²	146.1	100%	1.138	82%	0.817	S	S	*	*				0	128.3	0	-64.6	173	76	0	0	107
2	L	38.2	Very low	47.5	Very low	138 Å²	138	147.5 Å²	147.5	72%	0.723	82%	0.82	S	S	*	*			cis	-169.3	134.8	-4.1	-142.5	94.8	0	0	0	104.9
3	M	40.8	Very low	47.3	Very low	158 Å²	158	148.4 Å²	148.4	78%	0.778	82%	0.821	S	S	*	*			trans	56	102.4	152.9	-51.5	-49.8	167.9	0	0	122.1
4	I	54	Low	47	Very low	164 Å²	164	148.3 Å²	148.3	84%	0.841	82%	0.818	S	S	*	*			trans	-88.3	121.2	145.7	-61.1	166.6	0	0	0	106.4
5	P	54	Low	46.8	Very low	115 Å²	115	146.5 Å²	146.5	75%	0.747	82%	0.816	S	S	*	*			trans	-86.4	120.8	172.2	30.9	-25.5	0	0	0	110.1
6	L	48.6	Very low	47	Very low	167 Å²	167	145.4 Å²	145.4	87%	0.874	81%	0.814	S	S	*	*			trans	-98.9	101	169.1	-161.8	150.8	0	0	0	106.8
7	L	48.3	Very low	46.7	Very low	156 Å²	156	150.7 Å²	150.7	82%	0.817	82%	0.819	S	S	*	*			trans	-155.5	141.7	171.1	-74.9	166.5	0	0	0	107.4
8	V	48.5	Very low	46.4	Very low	116 Å²	116	148.6 Å²	148.6	70%	0.703	81%	0.814	S	S	*	*			cis	-162.2	144.5	-13.4	129.4	0	0	0	0	104.3	A10	V8-A10 PolarHBondContact O-N 3.3Å
9	L	49.9	Very low	46.5	Very low	165 Å²	165	153.4 Å²	153.4	86%	0.864	82%	0.819	S	S	*	*			trans	-61.5	123.8	166.9	-82.2	139.6	0	0	0	110.3
10	A	45	Very low	46.2	Very low	95 Å²	95	150.5 Å²	150.5	79%	0.785	82%	0.817	S	S	*	*			trans	-150.8	64.4	162.1	0	0	0	0	0	110.4	V8	V8-A10 PolarHBondContact O-N 3.3Å
11	S	50.3	Low	45.9	Very low	102 Å²	102	154.7 Å²	154.7	71%	0.713	82%	0.821	S	S	*	*			trans	-83.2	104.2	156.2	42.9	0	0	0	0	107.7
12	L	52.8	Low	45.9	Very low	163 Å²	163	149.8 Å²	149.8	85%	0.853	81%	0.808	S	S	*	*			trans	-169.8	134.4	157.5	-99.7	166.7	0	0	0	108.7
13	L	44.6	Very low	46.1	Very low	159 Å²	159	148.3 Å²	148.3	83%	0.832	81%	0.809	S	S	*	*			trans	94.6	80.9	170.6	-52.2	166.9	0	0	0	116.2	P15	L13-P15 WeakPolarHBondContact O-CD 3.36Å
14	D	43.7	Very low	46.7	Very low	147 Å²	147	147 Å²	147	79%	0.786	81%	0.813	S	S	*	*			trans	-58.8	125.3	150.1	-66.5	-55.4	0	0	0	109.8	V16	D14-V16 PolarHBondContact O-N 3.34Å
15	P	44.4	Very low	46.4	Very low	121 Å²	121	143.9 Å²	143.9	79%	0.786	81%	0.805	S	S	*	*			trans	-74.2	97	162.8	28.5	-28.8	0	0	0	108.3	L13 W17	L13-P15 WeakPolarHBondContact O-CD 3.36Å; P15-W17 PolarHBondContact O-N 3.43Å
16	V	49.3	Very low	46.1	Very low	129 Å²	129	147.5 Å²	147.5	78%	0.782	81%	0.812	S	S	*	*			trans	-61.3	100.9	165.6	176.4	0	0	0	0	107.9	D14	D14-V16 PolarHBondContact O-N 3.34Å
17	W	41.6	Very low	45.9	Very low	236 Å²	236	143.5 Å²	143.5	89%	0.894	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.3	133.2	168	-106.6	-40.3	0	0	0	109.7	P15 R19	P15-W17 PolarHBondContact O-N 3.43Å; W17-R19 PolarHBondContact O-N 3.31Å
18	P	41.4	Very low	45.4	Very low	113 Å²	113	142 Å²	142	73%	0.734	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-64.7	126.9	-179.4	-17.3	29.5	0	0	0	110.9	A20	P18-A20 PolarHBondContact O-N 3.27Å
19	R	48.6	Very low	45.3	Very low	239 Å²	239	142.2 Å²	142.2	90%	0.902	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-57	120.3	162.2	-75.2	-178.1	177	-170.6	-0.4	108.5	W17 R21	W17-R19 PolarHBondContact O-N 3.31Å; R19-R21 PolarHBondContact O-N 3.48Å; R19-R21 VanDerWaalsContact O-N 3.16Å
20	A	41.1	Very low	44.9	Very low	95 Å²	95	140 Å²	140	79%	0.785	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-58.5	118.4	166.1	0	0	0	0	0	108.7	P18 C22	P18-A20 PolarHBondContact O-N 3.27Å; A20-C22 PolarHBondContact O-N 3.11Å
21	R	39.3	Very low	45.1	Very low	240 Å²	240	145.3 Å²	145.3	91%	0.906	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.7	121.3	168.9	-85.2	-180	-94	-131.9	-3.5	108.1	R19	R19-R21 PolarHBondContact O-N 3.48Å; R19-R21 VanDerWaalsContact O-N 3.16Å
22	C	39.3	Very low	44.7	Very low	128 Å²	128	148.9 Å²	148.9	87%	0.865	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-77.5	124.6	166.6	-69.4	0	0	0	0	109.5	A20	A20-C22 PolarHBondContact O-N 3.11Å
23	S	42.5	Very low	44.2	Very low	106 Å²	106	151.4 Å²	151.4	74%	0.741	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71	138.7	169.2	-64.3	0	0	0	0	110.9	S25	S23-S25 PolarHBondContact O-N 2.97Å
24	P	52.5	Low	44.3	Very low	132 Å²	132	154.6 Å²	154.6	86%	0.857	81%	0.809	S	S	*	*	S	Bend	trans	-91.4	82	179.9	34.6	-30.3	0	0	0	110.6
25	S	49.1	Very low	44.3	Very low	98 Å²	98	155 Å²	155	69%	0.685	81%	0.812	S	S	*	*			trans	-173	91	160.4	57.3	0	0	0	0	111.3	S23	S23-S25 PolarHBondContact O-N 2.97Å
26	Q	47.2	Very low	44.3	Very low	191 Å²	191	153.2 Å²	153.2	89%	0.893	81%	0.807	S	S	*	*			trans	-169.4	120.1	144.8	-105.9	169.1	54.8	0	0	107.3	C28	Q26-C28 PolarHBondContact O-N 3.25Å
27	G	43.6	Very low	44.2	Very low	83 Å²	83	150.8 Å²	150.8	86%	0.856	81%	0.808	S	S	*	*			trans	-59.5	119	-174.7	0	0	0	0	0	111.3	D29	G27-D29 PolarHBondContact O-N 3.06Å; G27-D29 VanDerWaalsContact O-N 3.08Å
28	C	38.9	Very low	44.3	Very low	125 Å²	125	142.8 Å²	142.8	85%	0.845	80%	0.799	S	S	*	*			trans	-66.5	102.8	168.5	-64.4	0	0	0	0	108.8	Q26 P30	Q26-C28 PolarHBondContact O-N 3.25Å; C28-P30 WeakPolarHBondContact O-CD 3.44Å
29	D	45.2	Very low	44.8	Very low	119 Å²	119	149 Å²	149	64%	0.636	81%	0.807	S	S	*	*			trans	-66.9	119	166	-173	-8.2	0	0	0	108.9	G27 R31	G27-D29 PolarHBondContact O-N 3.06Å; G27-D29 VanDerWaalsContact O-N 3.08Å; D29-R31 PolarHBondContact O-N 2.95Å; D29-R31 WeakPolarHBondContact OD1-CB 3.34Å; D29-R31 PolarHBondContact OD1-N 3.46Å
30	P	42	Very low	44.7	Very low	118 Å²	118	141.3 Å²	141.3	77%	0.766	80%	0.803	S	S	*	*			trans	-71.2	9.7	-177.4	-15.2	29.9	0	0	0	115	C28	C28-P30 WeakPolarHBondContact O-CD 3.44Å
31	R	50.3	Low	44.9	Very low	207 Å²	207	139.5 Å²	139.5	78%	0.781	79%	0.793	S	S	*	*			trans	-106.2	41	-165.2	-71.6	-159.9	171.8	97.3	-2.8	117.7	D29	D29-R31 PolarHBondContact O-N 2.95Å; D29-R31 WeakPolarHBondContact OD1-CB 3.34Å; D29-R31 PolarHBondContact OD1-N 3.46Å
32	Q	41.8	Very low	45.2	Very low	178 Å²	178	134.2 Å²	134.2	83%	0.832	79%	0.788	S	S	*	*			trans	-146.2	70.9	152.5	-114.8	172.3	40.8	0	0	111.9	R34	Q32-R34 PolarHBondContact O-N 3.3Å
33	R	42	Very low	45.7	Very low	215 Å²	215	137.8 Å²	137.8	81%	0.811	78%	0.784	S	S	*	*			trans	-62.8	85.2	159.2	-156	-178	-160.6	-122.6	5.5	107.2	D35	R33-D35 PolarHBondContact O-N 3.14Å
34	R	45.8	Very low	46	Very low	226 Å²	226	138.9 Å²	138.9	85%	0.853	78%	0.778	S	S	*	*			trans	-43.1	129.9	167.6	-86.2	-179.1	-101.1	-166.6	-6.5	108.1	Q32 A36	Q32-R34 PolarHBondContact O-N 3.3Å; R34-A36 PolarHBondContact O-N 3.48Å
35	D	43.7	Very low	45.4	Very low	156 Å²	156	140 Å²	140	83%	0.834	77%	0.771	S	S	*	*			trans	-38.1	109.2	-168.4	-62.7	-68.5	0	0	0	113.6	R33 G37	R33-D35 PolarHBondContact O-N 3.14Å; D35-G37 PolarHBondContact O-N 3.49Å
36	A	44.2	Very low	45.3	Very low	83 Å²	83	143.5 Å²	143.5	69%	0.686	78%	0.781	S	S	*	*			trans	-71.4	35	164.1	0	0	0	0	0	111.5	R34	R34-A36 PolarHBondContact O-N 3.48Å
37	G	47.5	Very low	45.5	Very low	78 Å²	78	136.8 Å²	136.8	80%	0.804	76%	0.764	S	S	*	*			trans	-89.8	5	-176.6	0	0	0	0	0	114.8	D35	D35-G37 PolarHBondContact O-N 3.49Å
38	G	44.8	Very low	46.3	Very low	68 Å²	68	134.2 Å²	134.2	70%	0.701	74%	0.737	S	S	*	*	S	Bend	trans	-122	-20.7	-164	0	0	0	0	0	118
39	R	51.8	Low	47.9	Very low	243 Å²	243	131.9 Å²	131.9	92%	0.917	73%	0.727	S	S	*	*			trans	-145.3	92.6	-175.7	-67.3	-173.7	-177.5	-176.1	0.5	110.5	G41	R39-G41 PolarHBondContact O-N 2.95Å
40	G	47	Very low	49.7	Very low	78 Å²	78	129.4 Å²	129.4	80%	0.804	72%	0.717	S	S	*	*			trans	-64	120.4	166.7	0	0	0	0	0	108.9
41	G	44.8	Very low	52.2	Low	57 Å²	57	126.8 Å²	126.8	59%	0.588	69%	0.692	S	S	*	*			trans	-68.4	158.2	178.7	0	0	0	0	0	112.4	R39 Y43	R39-G41 PolarHBondContact O-N 2.95Å; G41-Y43 VanDerWaalsContact C-N 3.3Å; G41-Y43 PolarHBondContact O-N 2.87Å
42	V	46.1	Very low	54.3	Low	130 Å²	130	119.2 Å²	119.2	79%	0.788	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-23.1	-164.4	176.9	0	0	0	0	114
43	Y	48.1	Very low	57	Low	203 Å²	203	114.3 Å²	114.3	80%	0.796	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.1	87.5	169.4	-69.6	-77.8	0	0	0	110	G41 H45	G41-Y43 VanDerWaalsContact C-N 3.3Å; G41-Y43 PolarHBondContact O-N 2.87Å; Y43-H45 PolarHBondContact O-N 3.26Å
44	E	48.8	Very low	59.7	Low	128 Å²	128	104.3 Å²	104.3	60%	0.598	60%	0.6	S	S	*	*			trans	-73.7	72	165.6	-157.1	153.7	-152.8	0	0	107.4	L46 G47	E44-L46 PolarHBondContact O-N 3.19Å; E44-G47 PolarHBondContact O-N 3.39Å
45	H	40.9	Very low	62.2	Low	156 Å²	156	93.6 Å²	93.6	72%	0.722	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-25.9	113.4	-169.8	58.3	-72.5	0	0	0	113.7	Y43 G47	Y43-H45 PolarHBondContact O-N 3.26Å; H45-G47 PolarHBondContact O-N 3.07Å
46	L	47.4	Very low	64.7	Low	172 Å²	172	88.4 Å²	88.4	90%	0.901	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	16.3	166.6	-48.9	168.1	0	0	0	118.1	E44	E44-L46 PolarHBondContact O-N 3.19Å
47	G	51.6	Low	67.3	Low	50 Å²	50	84.5 Å²	84.5	52%	0.515	50%	0.496	S	S	.	.			trans	167	67.2	170.1	0	0	0	0	0	114.7	E44 H45	E44-G47 PolarHBondContact O-N 3.39Å; H45-G47 PolarHBondContact O-N 3.07Å
48	G	59.8	Low	69.7	Low	28 Å²	28	81.5 Å²	81.5	29%	0.289	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-56.4	142.1	176.6	0	0	0	0	0	112.3
49	A	71.3	Confident	72.3	Confident	77 Å²	77	79.4 Å²	79.4	64%	0.636	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-52.4	138.5	178.4	0	0	0	0	0	111	R51	A49-R51 PolarHBondContact O-N 3.08Å; A49-R51 VanDerWaalsContact O-N 3.13Å
50	P	84.5	Confident	74.5	Confident	67 Å²	67	73.5 Å²	73.5	44%	0.435	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-52.1	122.9	-179.6	-26.7	32.9	0	0	0	111.7	E85 T87	P50-E85 HydrophobicContact CB-CG 3.48Å; P50-E85 VanDerWaalsContact CB-CG 3.48Å; P50-T87 HydrophobicContact CG-CG2 4.42Å
51	R	93.7	Very high	76.9	Confident	62 Å²	62	71.8 Å²	71.8	23%	0.234	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.3	-177.8	62.6	-172.5	175.2	103.6	4.6	109.8	A49 I86 E127	A49-R51 PolarHBondContact O-N 3.08Å; A49-R51 VanDerWaalsContact O-N 3.13Å; R51-I86 HydrophobicContact CG-CB 3.8Å; R51-I86 WeakPolarHBondContact CG-O 3.39Å; R51-I86 PolarHBondContact N-O 3.04Å; R51-I86 VanDerWaalsContact NH2-CG2 3.33Å; R51-I86 PolarHBondContact O-N 3.1Å; R51-E127 IonicContact CZ-OE1 3.03Å; R51-E127 IonicContact CZ-OE2 2.63Å; R51-E127 IonicContact NH1-OE1 2.81Å; R51-E127 IonicContact NH2-OE1 3.6Å; R51-E127 PolarHBondContact NH2-OE1 2.95Å; R51-E127 IonicContact NH2-OE2 3.64Å; R51-E127 PolarHBondContact NH2-OE2 3.41Å
52	R	95.8	Very high	79.5	Confident	48 Å²	48	69.3 Å²	69.3	18%	0.181	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.6	177.7	-66.8	175.5	178.5	-176	-10.9	110.7	M84 E85 L192 R204	R52-M84 CarbonylContact C-O 3.52Å; R52-M84 VanDerWaalsContact CA-O 3.26Å; R52-M84 WeakPolarHBondContact CA-O 3.11Å; R52-E85 IonicContact NE-OE2 3.72Å; R52-E85 IonicContact NH2-OE2 2.61Å; R52-L192 HydrophobicContact CB-CD1 3.79Å; R52-L192 HydrophobicContact CB-CG 4.35Å; R52-R204 VanDerWaalsContact NH2-NH2 3.18Å
53	R	97.3	Very high	82	Confident	76 Å²	76	63.1 Å²	63.1	29%	0.287	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	161.5	-173.3	-63.6	-64.8	179.9	-95.9	3.7	110.4	M84 I86 P189 R190	R53-M84 PolarHBondContact N-O 3.32Å; R53-M84 WeakPolarHBondContact O-CB 3.43Å; R53-M84 PolarHBondContact O-N 2.7Å; R53-I86 HydrophobicContact CB-CD1 4.13Å; R53-I86 HydrophobicContact CG-CD1 4.41Å; R53-P189 HydrophobicContact CB-CB 4.44Å; R53-P189 HydrophobicContact CG-CB 4.32Å; R53-R190 VanDerWaalsContact CA-O 3.29Å; R53-R190 WeakPolarHBondContact CA-O 3.39Å; R53-R190 WeakPolarHBondContact CB-O 3.48Å; R53-R190 WeakPolarHBondContact CD-O 3.5Å
54	K	98	Very high	84.4	Confident	5 Å²	5	54 Å²	54	2%	0.022	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	135.2	159.6	-62.3	-174.4	170	162.9	0	109.2	Y56 E77 S82 R190 L192 D196	K54-Y56 PolarHBondContact O-N 2.86Å; K54-E77 PolarHBondContact NZ-O 3.32Å; K54-S82 WeakPolarHBondContact CD-OG 3.21Å; K54-S82 WeakPolarHBondContact CE-OG 3.39Å; K54-R190 HydrophobicContact CB-CB 4.48Å; K54-R190 PolarHBondContact N-O 2.69Å; K54-R190 PolarHBondContact O-N 3.23Å; K54-L192 HydrophobicContact CG-CD2 3.88Å; K54-D196 VanDerWaalsContact CE-CG 3.48Å; K54-D196 WeakPolarHBondContact CE-OD1 3.44Å; K54-D196 WeakPolarHBondContact CE-OD2 3.49Å; K54-D196 IonicContact NZ-OD1 2.77Å; K54-D196 PolarHBondContact NZ-OD1 3.09Å; K54-D196 IonicContact NZ-OD2 3.73Å; K54-D196 PolarHBondContact NZ-OD2 2.96Å
55	L	98.3	Very high	86.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	97.5	178	-66.5	177.9	0	0	0	109.4	H62 L63 I86 I96 Y137 F187 P189	L55-H62 WeakPolarHBondContact O-CA 3.33Å; L55-L63 HydrophobicContact CB-CB 4.21Å; L55-L63 HydrophobicContact CD1-CD2 4.17Å; L55-L63 PolarHBondContact O-N 2.85Å; L55-I86 HydrophobicContact CD2-CD1 3.93Å; L55-I86 HydrophobicContact CG-CD1 4.42Å; L55-I96 HydrophobicContact CD1-CD1 4.01Å; L55-I96 HydrophobicContact CD1-CG2 4.13Å; L55-Y137 HydrophobicContact CD1-CE2 4.38Å; L55-Y137 HydrophobicContact CD2-CE2 4.01Å; L55-Y137 VanDerWaalsContact CD2-OH 3.32Å; L55-Y137 WeakPolarHBondContact CD2-OH 3.09Å; L55-F187 HydrophobicContact CB-CB 4.41Å; L55-F187 HydrophobicContact CB-CD1 3.99Å; L55-P189 HydrophobicContact CD2-CB 4.23Å; L55-P189 HydrophobicContact CD2-CG 4.39Å
56	Y	98.1	Very high	89.5	Confident	47 Å²	47	41.3 Å²	41.3	18%	0.184	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	109	-179.4	-177.5	-109.6	0	0	0	110.8	K54 K60 H62 F187 L188	K54-Y56 PolarHBondContact O-N 2.86Å; Y56-K60 HydrophobicContact CE1-CD 4.36Å; Y56-K60 WeakPolarHBondContact CE2-O 3.45Å; Y56-K60 WeakPolarHBondContact OH-CA 3.29Å; Y56-K60 WeakPolarHBondContact OH-CD 3.33Å; Y56-H62 AromaticContact CD2-CD2 3.79Å; Y56-H62 AromaticContact CD2-CE1 3.59Å; Y56-H62 AromaticContact CD2-CG 3.98Å; Y56-H62 AromaticContact CD2-ND1 3.84Å; Y56-H62 AromaticContact CD2-NE2 3.56Å; Y56-F187 CarbonylContact O-C 3.48Å; Y56-F187 WeakPolarHBondContact O-CA 3.33Å; Y56-L188 PolarHBondContact N-O 3.22Å; Y56-L188 PolarHBondContact O-N 3.35Å
57	C	98.4	Very high	91.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	146.4	179.5	-167.5	0	0	0	0	111.1	T59 K60 Y61 K183 A184 L186 F187	C57-T59 PolarHBondContact O-N 3.26Å; C57-T59 PolarHBondContact SG-OG1 3.44Å; C57-K60 WeakPolarHBondContact O-CA 3.5Å; C57-K60 PolarHBondContact O-N 3.06Å; C57-Y61 VanDerWaalsContact CB-O 3.28Å; C57-Y61 WeakPolarHBondContact CB-O 3.43Å; C57-Y61 PolarHBondContact N-O 2.98Å; C57-K183 PolarHBondContact SG-O 3.19Å; C57-A184 PolarHBondContact SG-O 2.66Å; C57-L186 CarbonylContact C-O 3.54Å; C57-L186 VanDerWaalsContact CA-O 3.31Å; C57-L186 WeakPolarHBondContact CA-O 3.26Å; C57-F187 HydrophobicContact CB-CD1 3.81Å; C57-F187 HydrophobicContact CB-CE1 3.61Å; C57-F187 HydrophobicContact CB-CZ 4.31Å
58	A	98.1	Very high	94.1	Very high	16 Å²	16	39.7 Å²	39.7	13%	0.132	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.6	173.5	0	0	0	0	0	112.9	K60 Y134 K183 L186	A58-K60 PolarHBondContact O-N 3.48Å; A58-Y134 HydrophobicContact CB-CD1 4.35Å; A58-Y134 HydrophobicContact CB-CE1 3.69Å; A58-K183 HydrophobicContact CB-CB 4.2Å; A58-K183 WeakPolarHBondContact CB-O 3.4Å; A58-L186 HydrophobicContact CB-CB 3.97Å; A58-L186 PolarHBondContact N-O 3.4Å
59	T	98.2	Very high	95.9	Very high	24 Å²	24	39.5 Å²	39.5	15%	0.147	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	7.1	167.6	59.3	0	0	0	0	114.3	C57 Y61 I166 K183 A184	C57-T59 PolarHBondContact O-N 3.26Å; C57-T59 PolarHBondContact SG-OG1 3.44Å; T59-Y61 WeakPolarHBondContact O-CD2 2.93Å; T59-Y61 WeakPolarHBondContact O-CE2 3.5Å; T59-I166 WeakPolarHBondContact CG2-O 3.48Å; T59-I166 PolarHBondContact OG1-O 3.07Å; T59-K183 HydrophobicContact CG2-CB 4.38Å; T59-A184 HydrophobicContact CG2-CB 4.14Å
60	K	97.9	Very high	97.2	Very high	119 Å²	119	42.2 Å²	42.2	52%	0.517	21%	0.205	S	C	.	.	S	Bend	trans	78.7	14.4	173.3	-47	-63.3	177.6	177.3	0	116.4	Y56 C57 A58 L75	Y56-K60 HydrophobicContact CE1-CD 4.36Å; Y56-K60 WeakPolarHBondContact CE2-O 3.45Å; Y56-K60 WeakPolarHBondContact OH-CA 3.29Å; Y56-K60 WeakPolarHBondContact OH-CD 3.33Å; C57-K60 WeakPolarHBondContact O-CA 3.5Å; C57-K60 PolarHBondContact O-N 3.06Å; A58-K60 PolarHBondContact O-N 3.48Å; K60-L75 VanDerWaalsContact O-CD2 3.31Å; K60-L75 WeakPolarHBondContact O-CD2 3.19Å
61	Y	98.6	Very high	97.8	Very high	41 Å²	41	39.6 Å²	39.6	16%	0.161	19%	0.187	C	C	.	.			trans	-110.6	143.6	175.7	-62.8	-94.2	0	0	0	111.7	C57 T59 S74 L75 I166 G168	C57-Y61 VanDerWaalsContact CB-O 3.28Å; C57-Y61 WeakPolarHBondContact CB-O 3.43Å; C57-Y61 PolarHBondContact N-O 2.98Å; T59-Y61 WeakPolarHBondContact O-CD2 2.93Å; T59-Y61 WeakPolarHBondContact O-CE2 3.5Å; Y61-S74 CarbonylContact C-O 3.49Å; Y61-S74 WeakPolarHBondContact CA-O 3.32Å; Y61-L75 HydrophobicContact CD1-CD2 3.78Å; Y61-L75 HydrophobicContact CD1-CG 3.89Å; Y61-L75 HydrophobicContact CE1-CD1 4.2Å; Y61-L75 HydrophobicContact CE1-CD2 3.74Å; Y61-L75 HydrophobicContact CE1-CG 3.67Å; Y61-L75 HydrophobicContact CG-CD2 4.28Å; Y61-I166 HydrophobicContact CG-CG2 4.49Å; Y61-G168 WeakPolarHBondContact CE2-O 3.46Å; Y61-G168 PolarHBondContact OH-O 3.01Å
62	H	98.6	Very high	98.1	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.028	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.8	162.4	-61.2	90.9	0	0	0	109.9	L55 Y56 Q64 G73 S74 R190	L55-H62 WeakPolarHBondContact O-CA 3.33Å; Y56-H62 AromaticContact CD2-CD2 3.79Å; Y56-H62 AromaticContact CD2-CE1 3.59Å; Y56-H62 AromaticContact CD2-CG 3.98Å; Y56-H62 AromaticContact CD2-ND1 3.84Å; Y56-H62 AromaticContact CD2-NE2 3.56Å; H62-Q64 PolarHBondContact O-N 3.28Å; H62-G73 CarbonylContact O-C 3.58Å; H62-G73 VanDerWaalsContact O-CA 3.28Å; H62-G73 WeakPolarHBondContact O-CA 3.46Å; H62-S74 PolarHBondContact N-O 3.28Å; H62-S74 PolarHBondContact O-N 3.03Å; H62-R190 PolarHBondContact NE2-NH1 2.94Å
63	L	98.7	Very high	98.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	134.8	170.8	-177.9	67.1	0	0	0	109.5	L55 I71 S82 M84 L105 I164 I166 F187	L55-L63 HydrophobicContact CB-CB 4.21Å; L55-L63 HydrophobicContact CD1-CD2 4.17Å; L55-L63 PolarHBondContact O-N 2.85Å; L63-I71 HydrophobicContact CD1-CG2 3.8Å; L63-S82 WeakPolarHBondContact O-CA 2.97Å; L63-M84 WeakPolarHBondContact O-CE 3.38Å; L63-L105 HydrophobicContact CD2-CD2 3.77Å; L63-I164 HydrophobicContact CD2-CG2 4.46Å; L63-I166 HydrophobicContact CD1-CD1 3.61Å; L63-I166 HydrophobicContact CD1-CG1 3.78Å; L63-F187 HydrophobicContact CB-CE1 4.28Å
64	Q	98.4	Very high	98.2	Very high	11 Å²	11	33.2 Å²	33.2	5%	0.051	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.2	175.3	59.8	175.5	-13.2	0	0	112	H62 H66 D72 N79 F81	H62-Q64 PolarHBondContact O-N 3.28Å; Q64-H66 VanDerWaalsContact CD-NE2 3.26Å; Q64-H66 PolarHBondContact NE2-NE2 3.47Å; Q64-H66 PolarHBondContact OE1-CE1 3.27Å; Q64-D72 VanDerWaalsContact CG-O 3.24Å; Q64-D72 WeakPolarHBondContact CG-O 3.26Å; Q64-D72 WeakPolarHBondContact CG-OD1 3.47Å; Q64-D72 PolarHBondContact N-O 3.48Å; Q64-D72 PolarHBondContact NE2-OD1 3.06Å; Q64-D72 PolarHBondContact O-N 3.04Å; Q64-N79 PolarHBondContact OE1-ND2 3.43Å; Q64-F81 VanDerWaalsContact CA-O 3.26Å; Q64-F81 WeakPolarHBondContact CA-O 3.34Å; Q64-F81 HydrophobicContact CB-CB 4.1Å; Q64-F81 WeakPolarHBondContact CB-O 3.49Å
65	I	98.8	Very high	98.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	110	177.8	-54.7	173.9	0	0	0	107.8	I71 F81 M84 S101 K103 L105 A115	I65-I71 HydrophobicContact CG1-CG1 4.3Å; I65-I71 HydrophobicContact CG2-CG1 4.36Å; I65-F81 PolarHBondContact N-O 3.23Å; I65-M84 HydrophobicContact CB-CE 4.46Å; I65-M84 HydrophobicContact CD1-CE 4.2Å; I65-M84 HydrophobicContact CD1-SD 3.86Å; I65-M84 HydrophobicContact CG1-CE 3.88Å; I65-M84 HydrophobicContact CG1-SD 4.21Å; I65-S101 VanDerWaalsContact O-CB 3.26Å; I65-S101 WeakPolarHBondContact O-CB 3.36Å; I65-S101 PolarHBondContact O-OG 2.85Å; I65-S101 VanDerWaalsContact O-OG 3.05Å; I65-K103 HydrophobicContact CG2-CB 4.21Å; I65-L105 HydrophobicContact CD1-CB 3.93Å; I65-A115 HydrophobicContact CG2-CB 3.74Å
66	H	98.5	Very high	98	Very high	17 Å²	17	44.7 Å²	44.7	8%	0.079	23%	0.227	C	C	.	.			trans	-77.3	153	-176.9	-65.5	-91.5	0	0	0	111.5	Q64 N68 G69 R70 D72 F81	Q64-H66 VanDerWaalsContact CD-NE2 3.26Å; Q64-H66 PolarHBondContact NE2-NE2 3.47Å; Q64-H66 PolarHBondContact OE1-CE1 3.27Å; H66-N68 WeakPolarHBondContact CB-OD1 3.3Å; H66-N68 PolarHBondContact O-N 2.96Å; H66-G69 PolarHBondContact O-N 3.25Å; H66-R70 HydrophobicContact CB-CB 4.13Å; H66-R70 PolarHBondContact CD2-O 2.96Å; H66-R70 VanDerWaalsContact CD2-O 3.26Å; H66-R70 PolarHBondContact CE1-NH2 3.17Å; H66-R70 PolarHBondContact N-O 3.34Å; H66-R70 PolarHBondContact NE2-NH2 3.42Å; H66-D72 IonicContact CD2-OD1 3.62Å; H66-D72 PolarHBondContact CD2-OD1 3.44Å; H66-D72 IonicContact CE1-OD1 3.59Å; H66-D72 IonicContact NE2-OD1 3.64Å; H66-D72 PolarHBondContact NE2-OD1 3.1Å; H66-D72 IonicContact NE2-OD2 2.8Å; H66-F81 AromaticContact ND1-CD2 3.87Å
67	P	98	Very high	97.6	Very high	66 Å²	66	47.4 Å²	47.4	43%	0.429	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.3	173.7	-25.8	35.2	0	0	0	114	G69 F81 K103	P67-G69 PolarHBondContact O-N 3.41Å; P67-F81 HydrophobicContact CG-CD1 4.3Å; P67-F81 HydrophobicContact CG-CE1 3.67Å; P67-F81 HydrophobicContact CG-CZ 4.1Å; P67-K103 WeakPolarHBondContact O-CE 3.44Å
68	N	97.7	Very high	97.3	Very high	123 Å²	123	51.2 Å²	51.2	66%	0.658	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	1.1	174.9	68.7	8.1	0	0	0	114	H66 R70	H66-N68 WeakPolarHBondContact CB-OD1 3.3Å; H66-N68 PolarHBondContact O-N 2.96Å; N68-R70 VanDerWaalsContact OD1-CB 3.26Å; N68-R70 WeakPolarHBondContact OD1-CB 3.39Å; N68-R70 PolarHBondContact OD1-N 2.98Å
69	G	96.9	Very high	97.2	Very high	23 Å²	23	50.7 Å²	50.7	24%	0.237	26%	0.257	C	S	.	.	S	Bend	trans	87.4	-1.2	178.5	0	0	0	0	0	115.7	H66 P67 A115	H66-G69 PolarHBondContact O-N 3.25Å; P67-G69 PolarHBondContact O-N 3.41Å; G69-A115 WeakPolarHBondContact O-CB 3.43Å
70	R	98.3	Very high	97.2	Very high	135 Å²	135	51.2 Å²	51.2	51%	0.509	26%	0.26	S	S	.	.			trans	-64.7	142.9	171.6	-174.1	175.8	68.7	-177.4	-0.4	110.5	H66 N68 D72	H66-R70 HydrophobicContact CB-CB 4.13Å; H66-R70 PolarHBondContact CD2-O 2.96Å; H66-R70 VanDerWaalsContact CD2-O 3.26Å; H66-R70 PolarHBondContact CE1-NH2 3.17Å; H66-R70 PolarHBondContact N-O 3.34Å; H66-R70 PolarHBondContact NE2-NH2 3.42Å; N68-R70 VanDerWaalsContact OD1-CB 3.26Å; N68-R70 WeakPolarHBondContact OD1-CB 3.39Å; N68-R70 PolarHBondContact OD1-N 2.98Å; R70-D72 IonicContact CZ-OD2 2.7Å; R70-D72 IonicContact NE-OD2 3.59Å; R70-D72 PolarHBondContact NE-OD2 3.23Å; R70-D72 IonicContact NH2-OD2 3.52Å
71	I	98.8	Very high	97.2	Very high	12 Å²	12	48.5 Å²	48.5	6%	0.062	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.1	173	-64	165.2	0	0	0	108.7	L63 I65 L105 L113 Y114 A115 P172	L63-I71 HydrophobicContact CD1-CG2 3.8Å; I65-I71 HydrophobicContact CG1-CG1 4.3Å; I65-I71 HydrophobicContact CG2-CG1 4.36Å; I71-L105 HydrophobicContact CD1-CD1 3.53Å; I71-L105 HydrophobicContact CG1-CD1 4.48Å; I71-L105 HydrophobicContact CG2-CD1 4.4Å; I71-L113 HydrophobicContact CD1-CB 4.21Å; I71-Y114 VanDerWaalsContact CD1-O 3.29Å; I71-Y114 WeakPolarHBondContact CD1-O 3.41Å; I71-A115 HydrophobicContact CD1-CB 4.19Å; I71-A115 HydrophobicContact CG1-CB 4.38Å; I71-P172 WeakPolarHBondContact O-CD 3.48Å; I71-P172 WeakPolarHBondContact O-CG 3.19Å
72	D	98.6	Very high	97.2	Very high	30 Å²	30	46.6 Å²	46.6	16%	0.16	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	-174	177.5	56.1	1.5	0	0	0	109.7	Q64 H66 R70 G170	Q64-D72 VanDerWaalsContact CG-O 3.24Å; Q64-D72 WeakPolarHBondContact CG-O 3.26Å; Q64-D72 WeakPolarHBondContact CG-OD1 3.47Å; Q64-D72 PolarHBondContact N-O 3.48Å; Q64-D72 PolarHBondContact NE2-OD1 3.06Å; Q64-D72 PolarHBondContact O-N 3.04Å; H66-D72 IonicContact CD2-OD1 3.62Å; H66-D72 PolarHBondContact CD2-OD1 3.44Å; H66-D72 IonicContact CE1-OD1 3.59Å; H66-D72 IonicContact NE2-OD1 3.64Å; H66-D72 PolarHBondContact NE2-OD1 3.1Å; H66-D72 IonicContact NE2-OD2 2.8Å; R70-D72 IonicContact CZ-OD2 2.7Å; R70-D72 IonicContact NE-OD2 3.59Å; R70-D72 PolarHBondContact NE-OD2 3.23Å; R70-D72 IonicContact NH2-OD2 3.52Å; D72-G170 CarbonylContact C-O 3.45Å; D72-G170 WeakPolarHBondContact CA-O 3.4Å; D72-G170 WeakPolarHBondContact CB-O 2.9Å
73	G	98.4	Very high	97.2	Very high	11 Å²	11	46.3 Å²	46.3	11%	0.113	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140	175.5	0	0	0	0	0	111.1	H62 G170	H62-G73 CarbonylContact O-C 3.58Å; H62-G73 VanDerWaalsContact O-CA 3.28Å; H62-G73 WeakPolarHBondContact O-CA 3.46Å; G73-G170 PolarHBondContact N-O 3.48Å
74	S	97.7	Very high	97.2	Very high	10 Å²	10	46.3 Å²	46.3	7%	0.07	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	147.9	172.9	-171.5	0	0	0	0	111.2	Y61 H62 E76 N79	Y61-S74 CarbonylContact C-O 3.49Å; Y61-S74 WeakPolarHBondContact CA-O 3.32Å; H62-S74 PolarHBondContact N-O 3.28Å; H62-S74 PolarHBondContact O-N 3.03Å; S74-E76 WeakPolarHBondContact OG-CB 3.14Å; S74-E76 PolarHBondContact OG-N 2.94Å; S74-E76 VanDerWaalsContact OG-N 3.07Å; S74-N79 WeakPolarHBondContact CB-ND2 3.26Å; S74-N79 PolarHBondContact OG-ND2 3.36Å
75	L	97.1	Very high	97.1	Very high	121 Å²	121	47.6 Å²	47.6	63%	0.634	25%	0.246	S	C	*	.			trans	-91.1	-10.8	167.7	-64.5	172.9	0	0	0	111.9	K60 Y61 E77	K60-L75 VanDerWaalsContact O-CD2 3.31Å; K60-L75 WeakPolarHBondContact O-CD2 3.19Å; Y61-L75 HydrophobicContact CD1-CD2 3.78Å; Y61-L75 HydrophobicContact CD1-CG 3.89Å; Y61-L75 HydrophobicContact CE1-CD1 4.2Å; Y61-L75 HydrophobicContact CE1-CD2 3.74Å; Y61-L75 HydrophobicContact CE1-CG 3.67Å; Y61-L75 HydrophobicContact CG-CD2 4.28Å; L75-E77 PolarHBondContact O-N 3.15Å
76	E	95.4	Very high	97.1	Very high	126 Å²	126	47.7 Å²	47.7	59%	0.589	25%	0.246	S	C	*	.			trans	-74.4	117.1	-176.3	-65.8	171.5	-164.3	0	0	110.6	S74 N78 N79	S74-E76 WeakPolarHBondContact OG-CB 3.14Å; S74-E76 PolarHBondContact OG-N 2.94Å; S74-E76 VanDerWaalsContact OG-N 3.07Å; E76-N78 VanDerWaalsContact C-N 3.33Å; E76-N78 PolarHBondContact O-N 2.8Å; E76-N79 HydrophobicContact CB-CB 3.93Å
77	E	88.9	Confident	96.9	Very high	104 Å²	104	48.8 Å²	48.8	49%	0.486	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-32.7	-179.8	-173.7	162.8	-138.9	0	0	112.3	K54 L75 N79 R190	K54-E77 PolarHBondContact NZ-O 3.32Å; L75-E77 PolarHBondContact O-N 3.15Å; E77-N79 PolarHBondContact O-N 3.18Å; E77-R190 IonicContact OE1-CZ 3.97Å; E77-R190 IonicContact OE1-NH1 2.67Å; E77-R190 PolarHBondContact OE1-NH1 3.26Å; E77-R190 IonicContact OE1-NH2 3.37Å; E77-R190 PolarHBondContact OE1-NH2 2.7Å
78	N	92.4	Very high	96.7	Very high	80 Å²	80	48 Å²	48	43%	0.428	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	40.1	-176.6	-60.7	-53.7	0	0	0	113.1	E76 K195	E76-N78 VanDerWaalsContact C-N 3.33Å; E76-N78 PolarHBondContact O-N 2.8Å; N78-K195 WeakPolarHBondContact OD1-CD 3.49Å
79	N	96	Very high	96.6	Very high	6 Å²	6	45 Å²	45	3%	0.032	24%	0.239	C	C	.	.			trans	-96.1	119.2	-177.8	177.8	-7.9	0	0	0	112	Q64 S74 E76 E77 F81 S82	Q64-N79 PolarHBondContact OE1-ND2 3.43Å; S74-N79 WeakPolarHBondContact CB-ND2 3.26Å; S74-N79 PolarHBondContact OG-ND2 3.36Å; E76-N79 HydrophobicContact CB-CB 3.93Å; E77-N79 PolarHBondContact O-N 3.18Å; N79-F81 VanDerWaalsContact C-N 3.28Å; N79-F81 PolarHBondContact O-N 3.44Å; N79-F81 WeakPolarHBondContact OD1-CB 3.21Å; N79-F81 PolarHBondContact OD1-N 3.15Å; N79-S82 PolarHBondContact O-N 3.31Å; N79-S82 PolarHBondContact O-OG 2.91Å
80	P	97.3	Very high	96.4	Very high	34 Å²	34	47.5 Å²	47.5	22%	0.221	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-63.8	-30.4	-179	25.3	-33.9	0	0	0	113.4	S82 I83 F100 M199	P80-S82 PolarHBondContact O-N 3.44Å; P80-I83 WeakPolarHBondContact O-CB 3.39Å; P80-I83 PolarHBondContact O-N 3.11Å; P80-I83 VanDerWaalsContact O-N 3.11Å; P80-F100 HydrophobicContact CB-CB 4.49Å; P80-F100 HydrophobicContact CB-CD1 3.81Å; P80-F100 HydrophobicContact CB-CD2 3.8Å; P80-F100 HydrophobicContact CB-CE1 3.91Å; P80-F100 HydrophobicContact CB-CE2 3.93Å; P80-F100 HydrophobicContact CB-CG 3.76Å; P80-F100 HydrophobicContact CB-CZ 3.98Å; P80-F100 WeakPolarHBondContact O-CD2 3.37Å; P80-M199 HydrophobicContact CB-SD 3.94Å; P80-M199 HydrophobicContact CG-SD 4.31Å
81	F	98.4	Very high	96	Very high	63 Å²	63	46.5 Å²	46.5	28%	0.276	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-71.6	-11.3	-179.8	-52.9	-42.3	0	0	0	113.4	Q64 I65 H66 P67 N79 M84 F100	Q64-F81 VanDerWaalsContact CA-O 3.26Å; Q64-F81 WeakPolarHBondContact CA-O 3.34Å; Q64-F81 HydrophobicContact CB-CB 4.1Å; Q64-F81 WeakPolarHBondContact CB-O 3.49Å; I65-F81 PolarHBondContact N-O 3.23Å; H66-F81 AromaticContact ND1-CD2 3.87Å; P67-F81 HydrophobicContact CG-CD1 4.3Å; P67-F81 HydrophobicContact CG-CE1 3.67Å; P67-F81 HydrophobicContact CG-CZ 4.1Å; N79-F81 VanDerWaalsContact C-N 3.28Å; N79-F81 PolarHBondContact O-N 3.44Å; N79-F81 WeakPolarHBondContact OD1-CB 3.21Å; N79-F81 PolarHBondContact OD1-N 3.15Å; F81-M84 VanDerWaalsContact O-CE 3.24Å; F81-M84 WeakPolarHBondContact O-CE 3.44Å; F81-F100 HydrophobicContact CD1-CB 4.14Å; F81-F100 HydrophobicContact CE1-CB 4.47Å
82	S	98.4	Very high	95.8	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-88.3	-6.9	173.4	74.2	0	0	0	0	113.8	K54 L63 N79 P80 M84	K54-S82 WeakPolarHBondContact CD-OG 3.21Å; K54-S82 WeakPolarHBondContact CE-OG 3.39Å; L63-S82 WeakPolarHBondContact O-CA 2.97Å; N79-S82 PolarHBondContact O-N 3.31Å; N79-S82 PolarHBondContact O-OG 2.91Å; P80-S82 PolarHBondContact O-N 3.44Å; S82-M84 PolarHBondContact O-N 2.86Å
83	I	98.4	Very high	95.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	113	178.5	-60.9	174.7	0	0	0	109	P80 L99 F100 L192 D196 M199 V200	P80-I83 WeakPolarHBondContact O-CB 3.39Å; P80-I83 PolarHBondContact O-N 3.11Å; P80-I83 VanDerWaalsContact O-N 3.11Å; I83-L99 HydrophobicContact CG2-CB 4.14Å; I83-L99 HydrophobicContact CG2-CD2 3.81Å; I83-L99 WeakPolarHBondContact O-CB 3.34Å; I83-L99 PolarHBondContact O-N 2.77Å; I83-F100 HydrophobicContact CB-CD2 4.32Å; I83-F100 HydrophobicContact CB-CE2 4.26Å; I83-F100 HydrophobicContact CD1-CE2 3.83Å; I83-L192 HydrophobicContact CG1-CD2 4.29Å; I83-L192 HydrophobicContact CG2-CD1 3.97Å; I83-L192 HydrophobicContact CG2-CD2 4.18Å; I83-D196 HydrophobicContact CD1-CB 3.82Å; I83-M199 HydrophobicContact CD1-CE 3.98Å; I83-V200 HydrophobicContact CD1-CG2 4.05Å; I83-V200 HydrophobicContact CG2-CG2 4.08Å
84	M	98.3	Very high	95.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.2	-178.8	-54.9	-60.5	159.4	0	0	110.7	R52 R53 L63 I65 F81 S82 I86 I96 K97	R52-M84 CarbonylContact C-O 3.52Å; R52-M84 VanDerWaalsContact CA-O 3.26Å; R52-M84 WeakPolarHBondContact CA-O 3.11Å; R53-M84 PolarHBondContact N-O 3.32Å; R53-M84 WeakPolarHBondContact O-CB 3.43Å; R53-M84 PolarHBondContact O-N 2.7Å; L63-M84 WeakPolarHBondContact O-CE 3.38Å; I65-M84 HydrophobicContact CB-CE 4.46Å; I65-M84 HydrophobicContact CD1-CE 4.2Å; I65-M84 HydrophobicContact CD1-SD 3.86Å; I65-M84 HydrophobicContact CG1-CE 3.88Å; I65-M84 HydrophobicContact CG1-SD 4.21Å; F81-M84 VanDerWaalsContact O-CE 3.24Å; F81-M84 WeakPolarHBondContact O-CE 3.44Å; S82-M84 PolarHBondContact O-N 2.86Å; M84-I86 HydrophobicContact CB-CG1 4.45Å; M84-I96 HydrophobicContact CB-CG2 4.11Å; M84-I96 HydrophobicContact CG-CG2 4.17Å; M84-I96 HydrophobicContact SD-CG2 4.29Å; M84-K97 CarbonylContact C-O 3.6Å; M84-K97 VanDerWaalsContact CA-O 3.3Å; M84-K97 WeakPolarHBondContact CA-O 3.29Å
85	E	97.5	Very high	95.7	Very high	39 Å²	39	46.3 Å²	46.3	18%	0.182	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.6	163.1	-174.7	168.5	91.3	0	0	107.9	P50 R52 K97 L99	P50-E85 HydrophobicContact CB-CG 3.48Å; P50-E85 VanDerWaalsContact CB-CG 3.48Å; R52-E85 IonicContact NE-OE2 3.72Å; R52-E85 IonicContact NH2-OE2 2.61Å; E85-K97 PolarHBondContact N-O 3.31Å; E85-K97 PolarHBondContact O-N 3.23Å; E85-L99 HydrophobicContact CB-CD1 4.42Å
86	I	97.1	Very high	95.8	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.6	179.9	-48.7	169.8	0	0	0	108	R51 R53 L55 M84 V94 A95 I96	R51-I86 HydrophobicContact CG-CB 3.8Å; R51-I86 WeakPolarHBondContact CG-O 3.39Å; R51-I86 PolarHBondContact N-O 3.04Å; R51-I86 VanDerWaalsContact NH2-CG2 3.33Å; R51-I86 PolarHBondContact O-N 3.1Å; R53-I86 HydrophobicContact CB-CD1 4.13Å; R53-I86 HydrophobicContact CG-CD1 4.41Å; L55-I86 HydrophobicContact CD2-CD1 3.93Å; L55-I86 HydrophobicContact CG-CD1 4.42Å; M84-I86 HydrophobicContact CB-CG1 4.45Å; I86-V94 HydrophobicContact CG2-CB 3.69Å; I86-V94 HydrophobicContact CG2-CG1 3.92Å; I86-V94 HydrophobicContact CG2-CG2 4.02Å; I86-A95 WeakPolarHBondContact CA-O 3.46Å; I86-I96 HydrophobicContact CG1-CG1 4.41Å; I86-I96 HydrophobicContact CG2-CG1 4.24Å
87	T	95.9	Very high	95.9	Very high	40 Å²	40	37.1 Å²	37.1	25%	0.245	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.8	-176.1	-54.7	0	0	0	0	108.6	P50 V89 V94 A95	P50-T87 HydrophobicContact CG-CG2 4.42Å; T87-V89 PolarHBondContact O-N 2.99Å; T87-V94 CarbonylContact O-C 3.54Å; T87-V94 VanDerWaalsContact O-CA 3.25Å; T87-V94 WeakPolarHBondContact O-CA 3.46Å; T87-A95 PolarHBondContact N-O 2.53Å; T87-A95 PolarHBondContact O-N 3.36Å
88	A	93.8	Very high	96.4	Very high	49 Å²	49	32.2 Å²	32.2	41%	0.405	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	124.3	171	0	0	0	0	0	108.7
89	V	94	Very high	96.6	Very high	60 Å²	60	29.5 Å²	29.5	36%	0.364	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-20.9	176.7	-63.2	0	0	0	0	111.9	T87 V93 A95 F119 E124	T87-V89 PolarHBondContact O-N 2.99Å; V89-V93 HydrophobicContact CG2-CB 3.99Å; V89-V93 HydrophobicContact CG2-CG1 3.6Å; V89-V93 PolarHBondContact N-O 3.46Å; V89-A95 HydrophobicContact CG1-CB 3.76Å; V89-F119 HydrophobicContact CG1-CE2 4.34Å; V89-F119 HydrophobicContact CG1-CZ 4.16Å; V89-E124 HydrophobicContact CG2-CG 4.23Å
90	D	93.7	Very high	96.7	Very high	75 Å²	75	31.8 Å²	31.8	40%	0.401	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	174	172.9	-157.1	-17.2	0	0	0	108.6	G92 V93 R140	D90-G92 PolarHBondContact O-N 3.31Å; D90-V93 HydrophobicContact CB-CB 3.8Å; D90-V93 HydrophobicContact CB-CG2 3.93Å; D90-V93 PolarHBondContact N-O 3.26Å; D90-V93 PolarHBondContact O-N 2.97Å; D90-V93 VanDerWaalsContact O-O 3.05Å; D90-R140 IonicContact OD2-CZ 3.98Å; D90-R140 IonicContact OD2-NH1 3.69Å; D90-R140 PolarHBondContact OD2-NH1 3.2Å; D90-R140 IonicContact OD2-NH2 3.44Å; D90-R140 PolarHBondContact OD2-NH2 2.99Å
91	V	90.6	Very high	96.7	Very high	115 Å²	115	31 Å²	31	70%	0.697	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	113	175.9	-178.6	0	0	0	0	109.8	V93	V91-V93 PolarHBondContact O-N 3.48Å
92	G	93.1	Very high	96.7	Very high	42 Å²	42	29.6 Å²	29.6	43%	0.433	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	10.9	-177.6	0	0	0	0	0	114.5	D90 V126 E127	D90-G92 PolarHBondContact O-N 3.31Å; G92-V126 CarbonylContact O-C 3.39Å; G92-V126 WeakPolarHBondContact O-CA 3.26Å; G92-E127 PolarHBondContact O-N 3.46Å
93	V	96.8	Very high	96.7	Very high	8 Å²	8	30.8 Å²	30.8	5%	0.048	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.4	176.6	-170.8	0	0	0	0	109.7	V89 D90 V91 E124 F125 V126	V89-V93 HydrophobicContact CG2-CB 3.99Å; V89-V93 HydrophobicContact CG2-CG1 3.6Å; V89-V93 PolarHBondContact N-O 3.46Å; D90-V93 HydrophobicContact CB-CB 3.8Å; D90-V93 HydrophobicContact CB-CG2 3.93Å; D90-V93 PolarHBondContact N-O 3.26Å; D90-V93 PolarHBondContact O-N 2.97Å; D90-V93 VanDerWaalsContact O-O 3.05Å; V91-V93 PolarHBondContact O-N 3.48Å; V93-E124 HydrophobicContact CG1-CB 3.84Å; V93-E124 HydrophobicContact CG1-CG 4.46Å; V93-F125 CarbonylContact C-O 3.54Å; V93-F125 VanDerWaalsContact CA-O 3.31Å; V93-F125 WeakPolarHBondContact CA-O 3.28Å; V93-V126 HydrophobicContact CG2-CG2 4.42Å
94	V	97.5	Very high	96.7	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150	-177.8	-59.7	0	0	0	0	111.9	I86 T87 I96 F125 E127 Y137	I86-V94 HydrophobicContact CG2-CB 3.69Å; I86-V94 HydrophobicContact CG2-CG1 3.92Å; I86-V94 HydrophobicContact CG2-CG2 4.02Å; T87-V94 CarbonylContact O-C 3.54Å; T87-V94 VanDerWaalsContact O-CA 3.25Å; T87-V94 WeakPolarHBondContact O-CA 3.46Å; V94-I96 HydrophobicContact CG2-CD1 4.41Å; V94-I96 HydrophobicContact CG2-CG1 4.14Å; V94-F125 HydrophobicContact CG2-CB 4.39Å; V94-F125 PolarHBondContact N-O 2.9Å; V94-F125 PolarHBondContact O-N 2.94Å; V94-E127 HydrophobicContact CG1-CB 4.15Å; V94-E127 HydrophobicContact CG2-CB 4.12Å; V94-Y137 HydrophobicContact CG2-CD1 3.85Å; V94-Y137 HydrophobicContact CG2-CE1 3.94Å
95	A	98.4	Very high	96.7	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.033	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	138.9	158	0	0	0	0	0	108.8	I86 T87 V89 Y104 F119	I86-A95 WeakPolarHBondContact CA-O 3.46Å; T87-A95 PolarHBondContact N-O 2.53Å; T87-A95 PolarHBondContact O-N 3.36Å; V89-A95 HydrophobicContact CG1-CB 3.76Å; A95-Y104 HydrophobicContact CB-CD1 4.29Å; A95-Y104 HydrophobicContact CB-CE1 4.37Å; A95-F119 HydrophobicContact CB-CD2 4.12Å; A95-F119 HydrophobicContact CB-CE2 3.68Å
96	I	98.8	Very high	96.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	118.4	178.1	-58.8	168	0	0	0	107.8	L55 M84 I86 V94 Y104 L105 F125 Y137 I164	L55-I96 HydrophobicContact CD1-CD1 4.01Å; L55-I96 HydrophobicContact CD1-CG2 4.13Å; M84-I96 HydrophobicContact CB-CG2 4.11Å; M84-I96 HydrophobicContact CG-CG2 4.17Å; M84-I96 HydrophobicContact SD-CG2 4.29Å; I86-I96 HydrophobicContact CG1-CG1 4.41Å; I86-I96 HydrophobicContact CG2-CG1 4.24Å; V94-I96 HydrophobicContact CG2-CD1 4.41Å; V94-I96 HydrophobicContact CG2-CG1 4.14Å; I96-Y104 WeakPolarHBondContact O-CA 3.26Å; I96-L105 HydrophobicContact CB-CB 4.18Å; I96-L105 HydrophobicContact CB-CD2 4.41Å; I96-L105 HydrophobicContact CD1-CD2 4.23Å; I96-L105 HydrophobicContact CG2-CB 4.42Å; I96-L105 HydrophobicContact CG2-CD2 4.4Å; I96-L105 PolarHBondContact O-N 3.22Å; I96-F125 HydrophobicContact CD1-CD2 4.34Å; I96-Y137 HydrophobicContact CD1-CD1 3.87Å; I96-Y137 HydrophobicContact CD1-CE1 4.1Å; I96-Y137 HydrophobicContact CD1-CG 4.17Å; I96-I164 HydrophobicContact CD1-CD1 4.09Å
97	K	98.6	Very high	96.9	Very high	53 Å²	53	31.2 Å²	31.2	23%	0.23	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.6	-179	-168.7	-179.4	-170.2	168.1	0	110.8	M84 E85 L99 G102 K103 Y104	M84-K97 CarbonylContact C-O 3.6Å; M84-K97 VanDerWaalsContact CA-O 3.3Å; M84-K97 WeakPolarHBondContact CA-O 3.29Å; E85-K97 PolarHBondContact N-O 3.31Å; E85-K97 PolarHBondContact O-N 3.23Å; K97-L99 PolarHBondContact O-N 3.22Å; K97-G102 VanDerWaalsContact CE-C 3.44Å; K97-G102 WeakPolarHBondContact CE-O 3.3Å; K97-K103 CarbonylContact C-O 3.48Å; K97-K103 WeakPolarHBondContact CA-O 3.44Å; K97-K103 WeakPolarHBondContact CG-O 3.3Å; K97-Y104 HydrophobicContact CB-CD1 3.94Å; K97-Y104 HydrophobicContact CB-CE1 3.96Å; K97-Y104 HydrophobicContact CD-CD1 4.46Å; K97-Y104 HydrophobicContact CD-CE1 3.91Å; K97-Y104 HydrophobicContact CD-CE2 4.07Å; K97-Y104 HydrophobicContact CG-CD1 4.18Å; K97-Y104 HydrophobicContact CG-CE1 4.12Å; K97-Y104 HydrophobicContact CG-CE2 4.47Å; K97-Y104 HydrophobicContact CG-CG 4.4Å; K97-Y104 PolarHBondContact NZ-OH 3.43Å
98	G	98.6	Very high	97	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	115.9	167.9	0	0	0	0	0	109.1	F100 S101 G102 K103	G98-F100 VanDerWaalsContact C-N 3.32Å; G98-F100 PolarHBondContact O-N 2.65Å; G98-S101 PolarHBondContact O-OG 2.78Å; G98-G102 WeakPolarHBondContact O-CA 3.33Å; G98-G102 PolarHBondContact O-N 3.49Å; G98-K103 PolarHBondContact N-O 3.29Å
99	L	97.8	Very high	97.2	Very high	24 Å²	24	33.3 Å²	33.3	13%	0.126	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-39.9	-171.3	-176.2	67.2	0	0	0	111.8	I83 E85 K97 V200 L203	I83-L99 HydrophobicContact CG2-CB 4.14Å; I83-L99 HydrophobicContact CG2-CD2 3.81Å; I83-L99 WeakPolarHBondContact O-CB 3.34Å; I83-L99 PolarHBondContact O-N 2.77Å; E85-L99 HydrophobicContact CB-CD1 4.42Å; K97-L99 PolarHBondContact O-N 3.22Å; L99-V200 HydrophobicContact CD2-CG1 4.17Å; L99-V200 HydrophobicContact CD2-CG2 3.7Å; L99-L203 HydrophobicContact CD2-CD2 4.45Å; L99-L203 HydrophobicContact CG-CD2 3.99Å
100	F	97.4	Very high	97.4	Very high	53 Å²	53	36 Å²	36	23%	0.232	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-32.2	-178.2	-77	-98.3	0	0	0	113.7	P80 F81 I83 G98 M199 V200 L203	P80-F100 HydrophobicContact CB-CB 4.49Å; P80-F100 HydrophobicContact CB-CD1 3.81Å; P80-F100 HydrophobicContact CB-CD2 3.8Å; P80-F100 HydrophobicContact CB-CE1 3.91Å; P80-F100 HydrophobicContact CB-CE2 3.93Å; P80-F100 HydrophobicContact CB-CG 3.76Å; P80-F100 HydrophobicContact CB-CZ 3.98Å; P80-F100 WeakPolarHBondContact O-CD2 3.37Å; F81-F100 HydrophobicContact CD1-CB 4.14Å; F81-F100 HydrophobicContact CE1-CB 4.47Å; I83-F100 HydrophobicContact CB-CD2 4.32Å; I83-F100 HydrophobicContact CB-CE2 4.26Å; I83-F100 HydrophobicContact CD1-CE2 3.83Å; G98-F100 VanDerWaalsContact C-N 3.32Å; G98-F100 PolarHBondContact O-N 2.65Å; F100-M199 HydrophobicContact CE1-CB 4.48Å; F100-M199 HydrophobicContact CZ-CB 3.77Å; F100-M199 WeakPolarHBondContact CZ-O 3.15Å; F100-V200 HydrophobicContact CE2-CG2 4.2Å; F100-L203 HydrophobicContact CD1-CD1 4.19Å; F100-L203 HydrophobicContact CD1-CD2 4.02Å; F100-L203 HydrophobicContact CD2-CD2 4.29Å; F100-L203 HydrophobicContact CE1-CB 3.93Å; F100-L203 HydrophobicContact CE1-CD1 4.28Å; F100-L203 HydrophobicContact CE1-CD2 4.01Å; F100-L203 HydrophobicContact CE1-CG 4.3Å; F100-L203 HydrophobicContact CE2-CD2 4.26Å; F100-L203 HydrophobicContact CG-CD2 4.16Å; F100-L203 HydrophobicContact CZ-CB 4.13Å; F100-L203 HydrophobicContact CZ-CD2 4.11Å
101	S	98.1	Very high	97.6	Very high	19 Å²	19	32.4 Å²	32.4	13%	0.133	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-21	174.9	53.8	0	0	0	0	112.5	I65 G98 K103	I65-S101 VanDerWaalsContact O-CB 3.26Å; I65-S101 WeakPolarHBondContact O-CB 3.36Å; I65-S101 PolarHBondContact O-OG 2.85Å; I65-S101 VanDerWaalsContact O-OG 3.05Å; G98-S101 PolarHBondContact O-OG 2.78Å; S101-K103 PolarHBondContact O-N 3.38Å
102	G	97.6	Very high	98	Very high	33 Å²	33	32.3 Å²	32.3	34%	0.34	17%	0.17	S	C	.	.			trans	69.5	6.9	-175.2	0	0	0	0	0	113.9	K97 G98	K97-G102 VanDerWaalsContact CE-C 3.44Å; K97-G102 WeakPolarHBondContact CE-O 3.3Å; G98-G102 WeakPolarHBondContact O-CA 3.33Å; G98-G102 PolarHBondContact O-N 3.49Å
103	K	98.8	Very high	98.3	Very high	24 Å²	24	31.4 Å²	31.4	10%	0.104	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-101.9	144.3	-175.5	-63	-179.3	-171.4	-79.3	0	111.6	I65 P67 K97 G98 S101 A115 S116 E117	I65-K103 HydrophobicContact CG2-CB 4.21Å; P67-K103 WeakPolarHBondContact O-CE 3.44Å; K97-K103 CarbonylContact C-O 3.48Å; K97-K103 WeakPolarHBondContact CA-O 3.44Å; K97-K103 WeakPolarHBondContact CG-O 3.3Å; G98-K103 PolarHBondContact N-O 3.29Å; S101-K103 PolarHBondContact O-N 3.38Å; K103-A115 HydrophobicContact CB-CB 3.95Å; K103-A115 HydrophobicContact CD-CB 3.76Å; K103-A115 HydrophobicContact CG-CB 4.48Å; K103-S116 CarbonylContact C-O 3.49Å; K103-S116 VanDerWaalsContact CA-O 3.3Å; K103-S116 WeakPolarHBondContact CA-O 3.29Å; K103-S116 WeakPolarHBondContact CB-O 3.2Å; K103-E117 HydrophobicContact CG-CG 4.39Å; K103-E117 IonicContact NZ-OE1 2.71Å; K103-E117 PolarHBondContact NZ-OE1 3.38Å
104	Y	98.9	Very high	98.4	Very high	50 Å²	50	34.1 Å²	34.1	20%	0.196	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	138.7	173.2	-65.5	-89.9	0	0	0	110.4	A95 I96 K97 A115 S116 F119	A95-Y104 HydrophobicContact CB-CD1 4.29Å; A95-Y104 HydrophobicContact CB-CE1 4.37Å; I96-Y104 WeakPolarHBondContact O-CA 3.26Å; K97-Y104 HydrophobicContact CB-CD1 3.94Å; K97-Y104 HydrophobicContact CB-CE1 3.96Å; K97-Y104 HydrophobicContact CD-CD1 4.46Å; K97-Y104 HydrophobicContact CD-CE1 3.91Å; K97-Y104 HydrophobicContact CD-CE2 4.07Å; K97-Y104 HydrophobicContact CG-CD1 4.18Å; K97-Y104 HydrophobicContact CG-CE1 4.12Å; K97-Y104 HydrophobicContact CG-CE2 4.47Å; K97-Y104 HydrophobicContact CG-CG 4.4Å; K97-Y104 PolarHBondContact NZ-OH 3.43Å; Y104-A115 CarbonylContact O-C 3.44Å; Y104-A115 WeakPolarHBondContact O-CA 3.25Å; Y104-S116 PolarHBondContact N-O 2.91Å; Y104-S116 PolarHBondContact O-N 2.8Å; Y104-F119 HydrophobicContact CD1-CD2 4.02Å; Y104-F119 HydrophobicContact CD2-CB 4.24Å; Y104-F119 HydrophobicContact CE1-CB 4.33Å; Y104-F119 HydrophobicContact CE1-CD2 4.06Å; Y104-F119 HydrophobicContact CE2-CB 3.97Å; Y104-F119 HydrophobicContact CG-CD2 4.48Å
105	L	98.9	Very high	98.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	134.2	163.1	-175.9	58.8	0	0	0	108.5	L63 I65 I71 I96 L113 C123 F125 I164	L63-L105 HydrophobicContact CD2-CD2 3.77Å; I65-L105 HydrophobicContact CD1-CB 3.93Å; I71-L105 HydrophobicContact CD1-CD1 3.53Å; I71-L105 HydrophobicContact CG1-CD1 4.48Å; I71-L105 HydrophobicContact CG2-CD1 4.4Å; I96-L105 HydrophobicContact CB-CB 4.18Å; I96-L105 HydrophobicContact CB-CD2 4.41Å; I96-L105 HydrophobicContact CD1-CD2 4.23Å; I96-L105 HydrophobicContact CG2-CB 4.42Å; I96-L105 HydrophobicContact CG2-CD2 4.4Å; I96-L105 PolarHBondContact O-N 3.22Å; L105-L113 HydrophobicContact CD1-CB 4.36Å; L105-L113 HydrophobicContact CD1-CD1 4.45Å; L105-L113 HydrophobicContact CD1-CD2 4.34Å; L105-C123 WeakPolarHBondContact O-CA 3.42Å; L105-F125 HydrophobicContact CB-CE2 4.22Å; L105-F125 HydrophobicContact CD2-CE2 4.38Å; L105-F125 HydrophobicContact CG-CE2 4.07Å; L105-F125 HydrophobicContact CG-CZ 4.05Å; L105-F125 VanDerWaalsContact O-CE2 3.28Å; L105-F125 WeakPolarHBondContact O-CE2 3.42Å; L105-I164 HydrophobicContact CD2-CD1 3.41Å; L105-I164 VanDerWaalsContact CD2-CD1 3.41Å; L105-I164 HydrophobicContact CD2-CG1 4.04Å; L105-I164 HydrophobicContact CD2-CG2 4.23Å; L105-I164 HydrophobicContact CG-CD1 4.26Å
106	A	98.9	Very high	98.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	158.6	177.6	0	0	0	0	0	110.8	L113 Y114 E122	A106-L113 VanDerWaalsContact O-CA 3.3Å; A106-L113 WeakPolarHBondContact O-CA 3.5Å; A106-Y114 HydrophobicContact CB-CD1 3.96Å; A106-Y114 HydrophobicContact CB-CD2 4.17Å; A106-Y114 HydrophobicContact CB-CE1 3.44Å; A106-Y114 VanDerWaalsContact CB-CE1 3.44Å; A106-Y114 HydrophobicContact CB-CE2 3.67Å; A106-Y114 HydrophobicContact CB-CG 4.31Å; A106-Y114 PolarHBondContact N-O 2.99Å; A106-Y114 PolarHBondContact O-N 3.34Å; A106-E122 VanDerWaalsContact CA-O 3.26Å; A106-E122 WeakPolarHBondContact CA-O 3.24Å; A106-E122 HydrophobicContact CB-CB 4.26Å
107	M	98.9	Very high	98.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	123.2	175.5	-175	-175.8	-62.2	0	0	110.4	R112 L113 E122 F125 H142 W162 I164	M107-R112 WeakPolarHBondContact CA-O 3.14Å; M107-L113 HydrophobicContact CB-CD2 3.99Å; M107-L113 HydrophobicContact CE-CD2 3.61Å; M107-L113 HydrophobicContact CG-CD2 4.25Å; M107-E122 PolarHBondContact N-O 2.98Å; M107-E122 WeakPolarHBondContact O-CB 3.15Å; M107-F125 HydrophobicContact CB-CE1 4.05Å; M107-F125 HydrophobicContact CB-CZ 4.44Å; M107-H142 PolarHBondContact O-CD2 3.25Å; M107-H142 VanDerWaalsContact O-CD2 3.26Å; M107-H142 PolarHBondContact O-NE2 2.77Å; M107-W162 HydrophobicContact SD-CB 3.9Å; M107-W162 HydrophobicContact SD-CE3 4.11Å; M107-I164 HydrophobicContact CE-CG1 4.37Å
108	N	98.6	Very high	98.4	Very high	34 Å²	34	44.5 Å²	44.5	18%	0.182	23%	0.225	C	C	.	.			trans	-84.5	174.2	179.5	65.8	20.7	0	0	0	114.1	K110 G111 R112 Y114 E122	N108-K110 PolarHBondContact O-N 2.94Å; N108-K110 VanDerWaalsContact O-N 3.12Å; N108-K110 PolarHBondContact OD1-N 3.41Å; N108-K110 VanDerWaalsContact OD1-N 3.16Å; N108-G111 VanDerWaalsContact O-CA 3.3Å; N108-G111 WeakPolarHBondContact O-CA 3.42Å; N108-G111 PolarHBondContact O-N 3.23Å; N108-G111 PolarHBondContact OD1-N 3.05Å; N108-R112 PolarHBondContact N-O 3.32Å; N108-R112 VanDerWaalsContact N-O 3.09Å; N108-R112 WeakPolarHBondContact OD1-CB 3.45Å; N108-R112 PolarHBondContact OD1-N 3.01Å; N108-R112 PolarHBondContact OD1-O 3.03Å; N108-Y114 HydrophobicContact CB-CD1 4.23Å; N108-Y114 HydrophobicContact CB-CE1 3.95Å; N108-E122 WeakPolarHBondContact CA-OE1 3.49Å
109	D	98.1	Very high	98.4	Very high	100 Å²	100	48.4 Å²	48.4	54%	0.535	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-24.1	174	70.3	-18.4	0	0	0	115.4	G111 H142 W162	D109-G111 VanDerWaalsContact C-N 3.26Å; D109-H142 PolarHBondContact N-NE2 3.28Å; D109-W162 WeakPolarHBondContact O-CH2 3.31Å; D109-W162 VanDerWaalsContact O-CZ3 3.29Å; D109-W162 WeakPolarHBondContact O-CZ3 3.4Å
110	K	98.1	Very high	98.4	Very high	115 Å²	115	49.8 Å²	49.8	50%	0.5	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	6.8	173.8	-67.6	168.3	-168.2	173.8	0	112.5	N108 R112 F176	N108-K110 PolarHBondContact O-N 2.94Å; N108-K110 VanDerWaalsContact O-N 3.12Å; N108-K110 PolarHBondContact OD1-N 3.41Å; N108-K110 VanDerWaalsContact OD1-N 3.16Å; K110-R112 HydrophobicContact CB-CG 4.49Å; K110-R112 PolarHBondContact O-N 3.2Å; K110-F176 VanDerWaalsContact O-CE1 3.32Å; K110-F176 WeakPolarHBondContact O-CE1 3.29Å
111	G	98.2	Very high	98.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.269	C	S	.	.			trans	67.2	15.5	-177.9	0	0	0	0	0	113.6	N108 D109 R174 G175	N108-G111 VanDerWaalsContact O-CA 3.3Å; N108-G111 WeakPolarHBondContact O-CA 3.42Å; N108-G111 PolarHBondContact O-N 3.23Å; N108-G111 PolarHBondContact OD1-N 3.05Å; D109-G111 VanDerWaalsContact C-N 3.26Å; G111-R174 CarbonylContact O-C 3.54Å; G111-R174 WeakPolarHBondContact O-CA 3.13Å; G111-G175 PolarHBondContact O-N 2.99Å
112	R	98.6	Very high	98.4	Very high	114 Å²	114	55.8 Å²	55.8	43%	0.43	27%	0.273	S	S	.	.			trans	-86.1	134.4	179	-66.1	-177.3	170.3	111.5	-12.9	109.5	M107 N108 K110 R174	M107-R112 WeakPolarHBondContact CA-O 3.14Å; N108-R112 PolarHBondContact N-O 3.32Å; N108-R112 VanDerWaalsContact N-O 3.09Å; N108-R112 WeakPolarHBondContact OD1-CB 3.45Å; N108-R112 PolarHBondContact OD1-N 3.01Å; N108-R112 PolarHBondContact OD1-O 3.03Å; K110-R112 HydrophobicContact CB-CG 4.49Å; K110-R112 PolarHBondContact O-N 3.2Å; R112-R174 HydrophobicContact CG-CG 4.43Å; R112-R174 VanDerWaalsContact NH2-NH2 3.16Å
113	L	98.8	Very high	98.5	Very high	22 Å²	22	54.2 Å²	54.2	12%	0.115	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.2	168	-60.4	-179.4	0	0	0	109.9	I71 L105 A106 M107 I164 P172	I71-L113 HydrophobicContact CD1-CB 4.21Å; L105-L113 HydrophobicContact CD1-CB 4.36Å; L105-L113 HydrophobicContact CD1-CD1 4.45Å; L105-L113 HydrophobicContact CD1-CD2 4.34Å; A106-L113 VanDerWaalsContact O-CA 3.3Å; A106-L113 WeakPolarHBondContact O-CA 3.5Å; M107-L113 HydrophobicContact CB-CD2 3.99Å; M107-L113 HydrophobicContact CE-CD2 3.61Å; M107-L113 HydrophobicContact CG-CD2 4.25Å; L113-I164 HydrophobicContact CD1-CG2 4.05Å; L113-I164 HydrophobicContact CD2-CG1 3.95Å; L113-P172 HydrophobicContact CB-CB 4.47Å; L113-P172 HydrophobicContact CD1-CB 4.01Å
114	Y	98.8	Very high	98.5	Very high	65 Å²	65	54.3 Å²	54.3	26%	0.255	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.9	173.5	73.1	-84.3	0	0	0	110.3	I71 A106 N108 N120 E122	I71-Y114 VanDerWaalsContact CD1-O 3.29Å; I71-Y114 WeakPolarHBondContact CD1-O 3.41Å; A106-Y114 HydrophobicContact CB-CD1 3.96Å; A106-Y114 HydrophobicContact CB-CD2 4.17Å; A106-Y114 HydrophobicContact CB-CE1 3.44Å; A106-Y114 VanDerWaalsContact CB-CE1 3.44Å; A106-Y114 HydrophobicContact CB-CE2 3.67Å; A106-Y114 HydrophobicContact CB-CG 4.31Å; A106-Y114 PolarHBondContact N-O 2.99Å; A106-Y114 PolarHBondContact O-N 3.34Å; N108-Y114 HydrophobicContact CB-CD1 4.23Å; N108-Y114 HydrophobicContact CB-CE1 3.95Å; Y114-N120 PolarHBondContact OH-ND2 3.01Å; Y114-E122 HydrophobicContact CE1-CB 4.49Å; Y114-E122 WeakPolarHBondContact CE1-OE2 3.45Å; Y114-E122 PolarHBondContact OH-OE2 3.08Å
115	A	98.8	Very high	98.5	Very high	17 Å²	17	52 Å²	52	14%	0.14	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112.2	179.3	0	0	0	0	0	109.9	I65 G69 I71 K103 Y104	I65-A115 HydrophobicContact CG2-CB 3.74Å; G69-A115 WeakPolarHBondContact O-CB 3.43Å; I71-A115 HydrophobicContact CD1-CB 4.19Å; I71-A115 HydrophobicContact CG1-CB 4.38Å; K103-A115 HydrophobicContact CB-CB 3.95Å; K103-A115 HydrophobicContact CD-CB 3.76Å; K103-A115 HydrophobicContact CG-CB 4.48Å; Y104-A115 CarbonylContact O-C 3.44Å; Y104-A115 WeakPolarHBondContact O-CA 3.25Å
116	S	98.7	Very high	98.5	Very high	15 Å²	15	53.6 Å²	53.6	11%	0.105	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	134.9	178.4	-166.4	0	0	0	0	111.3	K103 Y104 V118 N120	K103-S116 CarbonylContact C-O 3.49Å; K103-S116 VanDerWaalsContact CA-O 3.3Å; K103-S116 WeakPolarHBondContact CA-O 3.29Å; K103-S116 WeakPolarHBondContact CB-O 3.2Å; Y104-S116 PolarHBondContact N-O 2.91Å; Y104-S116 PolarHBondContact O-N 2.8Å; S116-V118 WeakPolarHBondContact CB-O 3.3Å; S116-V118 PolarHBondContact OG-O 3.36Å; S116-N120 PolarHBondContact OG-ND2 2.81Å
117	E	98.1	Very high	98.4	Very high	142 Å²	142	55.5 Å²	55.5	66%	0.664	27%	0.267	S	S	*	.	S	Bend	trans	-73.3	-33.2	173.9	-69.1	-175.9	173.2	0	0	112.3	K103	K103-E117 HydrophobicContact CG-CG 4.39Å; K103-E117 IonicContact NZ-OE1 2.71Å; K103-E117 PolarHBondContact NZ-OE1 3.38Å
118	V	97.8	Very high	98.3	Very high	107 Å²	107	62.3 Å²	62.3	65%	0.648	29%	0.293	S	S	*	.	S	Bend	trans	-115	139.5	-178.2	-176.4	0	0	0	0	108.9	S116 N120	S116-V118 WeakPolarHBondContact CB-O 3.3Å; S116-V118 PolarHBondContact OG-O 3.36Å; V118-N120 PolarHBondContact O-N 3.48Å
119	F	98	Very high	98	Very high	83 Å²	83	67.6 Å²	67.6	36%	0.364	32%	0.32	S	S	.	.			trans	-62.5	134	174.6	178.2	-101.5	0	0	0	110.7	V89 A95 Y104 C123 E124	V89-F119 HydrophobicContact CG1-CE2 4.34Å; V89-F119 HydrophobicContact CG1-CZ 4.16Å; A95-F119 HydrophobicContact CB-CD2 4.12Å; A95-F119 HydrophobicContact CB-CE2 3.68Å; Y104-F119 HydrophobicContact CD1-CD2 4.02Å; Y104-F119 HydrophobicContact CD2-CB 4.24Å; Y104-F119 HydrophobicContact CE1-CB 4.33Å; Y104-F119 HydrophobicContact CE1-CD2 4.06Å; Y104-F119 HydrophobicContact CE2-CB 3.97Å; Y104-F119 HydrophobicContact CG-CD2 4.48Å; F119-C123 HydrophobicContact CD2-CB 3.68Å; F119-C123 HydrophobicContact CE2-CB 3.69Å; F119-E124 HydrophobicContact CE2-CG 4.32Å; F119-E124 HydrophobicContact CZ-CG 3.84Å
120	N	98	Very high	97.5	Very high	53 Å²	53	65.6 Å²	65.6	28%	0.283	31%	0.307	S	S	.	.			trans	-146.7	175.7	178.1	68	34.9	0	0	0	110.3	Y114 S116 V118 E122 C123	Y114-N120 PolarHBondContact OH-ND2 3.01Å; S116-N120 PolarHBondContact OG-ND2 2.81Å; V118-N120 PolarHBondContact O-N 3.48Å; N120-E122 PolarHBondContact O-N 3.09Å; N120-E122 WeakPolarHBondContact OD1-CA 3.17Å; N120-E122 WeakPolarHBondContact OD1-CB 3.32Å; N120-E122 PolarHBondContact OD1-N 2.89Å; N120-C123 PolarHBondContact N-SG 3.31Å; N120-C123 WeakPolarHBondContact O-CB 3.26Å; N120-C123 PolarHBondContact O-N 3.26Å; N120-C123 PolarHBondContact OD1-N 2.86Å; N120-C123 PolarHBondContact OD1-SG 3.34Å
121	K	98.2	Very high	96.8	Very high	148 Å²	148	67 Å²	67	64%	0.643	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-60.8	-27.4	-178.6	-69.6	-172	177	-178.7	0	114.2	C123 E124 Q141	K121-C123 PolarHBondContact O-N 2.79Å; K121-E124 PolarHBondContact O-N 3.16Å; K121-Q141 HydrophobicContact CB-CG 4.08Å; K121-Q141 WeakPolarHBondContact O-CG 3.38Å
122	E	98.8	Very high	96.3	Very high	49 Å²	49	74.7 Å²	74.7	23%	0.229	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-75.2	-9.6	176.9	-64.5	-171.2	157.5	0	0	112.7	A106 M107 N108 Y114 N120 E124 H142	A106-E122 VanDerWaalsContact CA-O 3.26Å; A106-E122 WeakPolarHBondContact CA-O 3.24Å; A106-E122 HydrophobicContact CB-CB 4.26Å; M107-E122 PolarHBondContact N-O 2.98Å; M107-E122 WeakPolarHBondContact O-CB 3.15Å; N108-E122 WeakPolarHBondContact CA-OE1 3.49Å; Y114-E122 HydrophobicContact CE1-CB 4.49Å; Y114-E122 WeakPolarHBondContact CE1-OE2 3.45Å; Y114-E122 PolarHBondContact OH-OE2 3.08Å; N120-E122 PolarHBondContact O-N 3.09Å; N120-E122 WeakPolarHBondContact OD1-CA 3.17Å; N120-E122 WeakPolarHBondContact OD1-CB 3.32Å; N120-E122 PolarHBondContact OD1-N 2.89Å; E122-E124 VanDerWaalsContact C-N 3.31Å; E122-H142 IonicContact OE1-NE2 2.7Å
123	C	98.8	Very high	95.8	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-85	-3.1	173.7	-55.4	0	0	0	0	113.3	L105 F119 N120 K121 F125	L105-C123 WeakPolarHBondContact O-CA 3.42Å; F119-C123 HydrophobicContact CD2-CB 3.68Å; F119-C123 HydrophobicContact CE2-CB 3.69Å; N120-C123 PolarHBondContact N-SG 3.31Å; N120-C123 WeakPolarHBondContact O-CB 3.26Å; N120-C123 PolarHBondContact O-N 3.26Å; N120-C123 PolarHBondContact OD1-N 2.86Å; N120-C123 PolarHBondContact OD1-SG 3.34Å; K121-C123 PolarHBondContact O-N 2.79Å; C123-F125 WeakPolarHBondContact O-CD2 3.24Å; C123-F125 WeakPolarHBondContact O-CE2 3.38Å
124	E	98.6	Very high	95.7	Very high	27 Å²	27	72.2 Å²	72.2	13%	0.126	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.8	-176.7	-63.8	-175	-165.9	0	0	111.6	V89 V93 F119 K121 E122 R140	V89-E124 HydrophobicContact CG2-CG 4.23Å; V93-E124 HydrophobicContact CG1-CB 3.84Å; V93-E124 HydrophobicContact CG1-CG 4.46Å; F119-E124 HydrophobicContact CE2-CG 4.32Å; F119-E124 HydrophobicContact CZ-CG 3.84Å; K121-E124 PolarHBondContact O-N 3.16Å; E122-E124 VanDerWaalsContact C-N 3.31Å; E124-R140 HydrophobicContact CB-CB 4Å; E124-R140 WeakPolarHBondContact O-CB 3.42Å; E124-R140 PolarHBondContact O-N 3.39Å; E124-R140 WeakPolarHBondContact OE2-CD 3.19Å; E124-R140 IonicContact OE2-CZ 3.49Å; E124-R140 IonicContact OE2-NE 2.77Å; E124-R140 IonicContact OE2-NH1 3.43Å; E124-R140 PolarHBondContact OE2-NH1 3.39Å
125	F	98.8	Very high	95.6	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.8	178.6	-56.2	-80.3	0	0	0	112	V93 V94 I96 L105 M107 C123 E127 A138 I164	V93-F125 CarbonylContact C-O 3.54Å; V93-F125 VanDerWaalsContact CA-O 3.31Å; V93-F125 WeakPolarHBondContact CA-O 3.28Å; V94-F125 HydrophobicContact CG2-CB 4.39Å; V94-F125 PolarHBondContact N-O 2.9Å; V94-F125 PolarHBondContact O-N 2.94Å; I96-F125 HydrophobicContact CD1-CD2 4.34Å; L105-F125 HydrophobicContact CB-CE2 4.22Å; L105-F125 HydrophobicContact CD2-CE2 4.38Å; L105-F125 HydrophobicContact CG-CE2 4.07Å; L105-F125 HydrophobicContact CG-CZ 4.05Å; L105-F125 VanDerWaalsContact O-CE2 3.28Å; L105-F125 WeakPolarHBondContact O-CE2 3.42Å; M107-F125 HydrophobicContact CB-CE1 4.05Å; M107-F125 HydrophobicContact CB-CZ 4.44Å; C123-F125 WeakPolarHBondContact O-CD2 3.24Å; C123-F125 WeakPolarHBondContact O-CE2 3.38Å; F125-E127 PolarHBondContact O-N 2.84Å; F125-A138 CarbonylContact C-O 3.56Å; F125-A138 WeakPolarHBondContact CA-O 3.48Å; F125-I164 HydrophobicContact CB-CD1 4.4Å; F125-I164 HydrophobicContact CD1-CD1 3.4Å; F125-I164 HydrophobicContact CD1-CG1 3.84Å; F125-I164 HydrophobicContact CD2-CD1 3.83Å; F125-I164 HydrophobicContact CE1-CD1 3.47Å; F125-I164 VanDerWaalsContact CE1-CD1 3.47Å; F125-I164 HydrophobicContact CE1-CG1 3.62Å; F125-I164 HydrophobicContact CE2-CD1 3.88Å; F125-I164 HydrophobicContact CG-CD1 3.59Å; F125-I164 HydrophobicContact CZ-CD1 3.71Å; F125-I164 HydrophobicContact CZ-CG1 4.13Å
126	V	98.2	Very high	95.6	Very high	34 Å²	34	69.3 Å²	69.3	21%	0.206	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	112.2	169.3	-178.2	0	0	0	0	108.2	G92 V93 R128 Y137 A138 R140	G92-V126 CarbonylContact O-C 3.39Å; G92-V126 WeakPolarHBondContact O-CA 3.26Å; V93-V126 HydrophobicContact CG2-CG2 4.42Å; V126-R128 HydrophobicContact CG1-CG 4.25Å; V126-Y137 WeakPolarHBondContact O-CA 3.21Å; V126-A138 HydrophobicContact CB-CB 4.46Å; V126-A138 PolarHBondContact N-O 3.31Å; V126-A138 PolarHBondContact O-N 3.28Å; V126-R140 HydrophobicContact CG2-CB 4.3Å; V126-R140 HydrophobicContact CG2-CG 4.3Å
127	E	97.6	Very high	95.6	Very high	40 Å²	40	68.6 Å²	68.6	19%	0.187	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	126.1	174.8	177.7	172.4	-135.8	0	0	109.9	R51 G92 V94 F125 N135 T136 Y137	R51-E127 IonicContact CZ-OE1 3.03Å; R51-E127 IonicContact CZ-OE2 2.63Å; R51-E127 IonicContact NH1-OE1 2.81Å; R51-E127 IonicContact NH2-OE1 3.6Å; R51-E127 PolarHBondContact NH2-OE1 2.95Å; R51-E127 IonicContact NH2-OE2 3.64Å; R51-E127 PolarHBondContact NH2-OE2 3.41Å; G92-E127 PolarHBondContact O-N 3.46Å; V94-E127 HydrophobicContact CG1-CB 4.15Å; V94-E127 HydrophobicContact CG2-CB 4.12Å; F125-E127 PolarHBondContact O-N 2.84Å; E127-N135 HydrophobicContact CG-CB 4.42Å; E127-N135 PolarHBondContact OE1-ND2 2.94Å; E127-T136 WeakPolarHBondContact CA-O 3.34Å; E127-Y137 HydrophobicContact CB-CD1 3.98Å; E127-Y137 HydrophobicContact CB-CE1 3.93Å; E127-Y137 HydrophobicContact CG-CD1 4.15Å; E127-Y137 HydrophobicContact CG-CE1 3.68Å; E127-Y137 VanDerWaalsContact OE1-CE1 3.29Å; E127-Y137 WeakPolarHBondContact OE1-CE1 3.2Å; E127-Y137 PolarHBondContact OE1-OH 3.19Å
128	R	95.9	Very high	95.6	Very high	144 Å²	144	61.9 Å²	61.9	54%	0.543	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	131.7	171.2	-64.8	-172.4	176.2	-155.1	-2.3	110.5	V126 H130 N135 T136	V126-R128 HydrophobicContact CG1-CG 4.25Å; R128-H130 PolarHBondContact O-N 3.26Å; R128-N135 CarbonylContact O-C 3.46Å; R128-N135 VanDerWaalsContact O-CA 3.26Å; R128-N135 WeakPolarHBondContact O-CA 3.39Å; R128-T136 PolarHBondContact N-O 2.92Å; R128-T136 PolarHBondContact O-N 3.07Å
129	I	92.2	Very high	95.7	Very high	144 Å²	144	57.1 Å²	57.1	74%	0.738	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	129	168.7	-58.2	171.8	0	0	0	107.7
130	H	88.4	Confident	95.7	Very high	58 Å²	58	57.8 Å²	57.8	27%	0.269	28%	0.28	S	S	.	.			trans	-109.9	177.7	173.6	-162.4	54	0	0	0	109.3	R128 Y134 L186	R128-H130 PolarHBondContact O-N 3.26Å; H130-Y134 CarbonylContact C-O 3.58Å; H130-Y134 VanDerWaalsContact CA-O 3.29Å; H130-Y134 WeakPolarHBondContact CA-O 3.4Å; H130-Y134 VanDerWaalsContact CB-O 3.3Å; H130-Y134 WeakPolarHBondContact CB-O 3.45Å; H130-Y134 PolarHBondContact N-O 2.9Å; H130-L186 HydrophobicContact CB-CD2 4.23Å; H130-L186 WeakPolarHBondContact CD2-CD2 3.39Å
131	E	84.3	Confident	95.6	Very high	144 Å²	144	58.8 Å²	58.8	67%	0.673	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-59.5	154.9	-179	-62.6	175	-170.9	0	0	112	G133 Y134	E131-G133 PolarHBondContact O-N 3.31Å; E131-G133 VanDerWaalsContact O-N 3.09Å; E131-Y134 PolarHBondContact O-N 3.11Å
132	L	86.8	Confident	95.6	Very high	162 Å²	162	53.3 Å²	53.3	85%	0.848	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	57.9	24.4	175.2	-51.9	174.4	0	0	0	114.5	Y134	L132-Y134 VanDerWaalsContact C-N 3.32Å; L132-Y134 HydrophobicContact CB-CD2 4.31Å; L132-Y134 PolarHBondContact O-N 3.21Å
133	G	88	Confident	95.5	Very high	41 Å²	41	54.1 Å²	54.1	42%	0.423	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	79.6	7	176.1	0	0	0	0	0	115.2	E131 L188	E131-G133 PolarHBondContact O-N 3.31Å; E131-G133 VanDerWaalsContact O-N 3.09Å; G133-L188 VanDerWaalsContact O-CD1 3.29Å; G133-L188 WeakPolarHBondContact O-CD1 3.38Å
134	Y	96.2	Very high	95.3	Very high	44 Å²	44	56.7 Å²	56.7	17%	0.173	28%	0.278	C	S	.	.			trans	-75.1	152.2	168.8	-74	-90.7	0	0	0	110.5	A58 H130 E131 L132 L186 L188	A58-Y134 HydrophobicContact CB-CD1 4.35Å; A58-Y134 HydrophobicContact CB-CE1 3.69Å; H130-Y134 CarbonylContact C-O 3.58Å; H130-Y134 VanDerWaalsContact CA-O 3.29Å; H130-Y134 WeakPolarHBondContact CA-O 3.4Å; H130-Y134 VanDerWaalsContact CB-O 3.3Å; H130-Y134 WeakPolarHBondContact CB-O 3.45Å; H130-Y134 PolarHBondContact N-O 2.9Å; E131-Y134 PolarHBondContact O-N 3.11Å; L132-Y134 VanDerWaalsContact C-N 3.32Å; L132-Y134 HydrophobicContact CB-CD2 4.31Å; L132-Y134 PolarHBondContact O-N 3.21Å; Y134-L186 HydrophobicContact CD1-CB 3.76Å; Y134-L186 HydrophobicContact CE1-CB 4.47Å; Y134-L186 HydrophobicContact CG-CB 4.11Å; Y134-L188 HydrophobicContact CD1-CB 4Å; Y134-L188 HydrophobicContact CE1-CB 3.86Å
135	N	97.9	Very high	94.9	Very high	14 Å²	14	60.7 Å²	60.7	8%	0.075	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	154.8	170.3	-66	0.3	0	0	0	110	E127 R128 Y137 F187 P189	E127-N135 HydrophobicContact CG-CB 4.42Å; E127-N135 PolarHBondContact OE1-ND2 2.94Å; R128-N135 CarbonylContact O-C 3.46Å; R128-N135 VanDerWaalsContact O-CA 3.26Å; R128-N135 WeakPolarHBondContact O-CA 3.39Å; N135-Y137 HydrophobicContact CB-CE2 3.99Å; N135-F187 PolarHBondContact N-O 3.12Å; N135-F187 PolarHBondContact O-N 2.94Å; N135-P189 HydrophobicContact CB-CG 4.43Å
136	T	98.4	Very high	94	Very high	6 Å²	6	64.5 Å²	64.5	4%	0.037	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	150.6	166.1	56.4	0	0	0	0	109.5	E127 R128 L186	E127-T136 WeakPolarHBondContact CA-O 3.34Å; R128-T136 PolarHBondContact N-O 2.92Å; R128-T136 PolarHBondContact O-N 3.07Å; T136-L186 HydrophobicContact CG2-CD2 3.71Å
137	Y	98.7	Very high	92.8	Very high	1 Å²	1	68.9 Å²	68.9	0%	0.004	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	103.9	178.5	-57.6	-88.1	0	0	0	109	L55 V94 I96 V126 E127 N135 Y163 I164 F187	L55-Y137 HydrophobicContact CD1-CE2 4.38Å; L55-Y137 HydrophobicContact CD2-CE2 4.01Å; L55-Y137 VanDerWaalsContact CD2-OH 3.32Å; L55-Y137 WeakPolarHBondContact CD2-OH 3.09Å; V94-Y137 HydrophobicContact CG2-CD1 3.85Å; V94-Y137 HydrophobicContact CG2-CE1 3.94Å; I96-Y137 HydrophobicContact CD1-CD1 3.87Å; I96-Y137 HydrophobicContact CD1-CE1 4.1Å; I96-Y137 HydrophobicContact CD1-CG 4.17Å; V126-Y137 WeakPolarHBondContact O-CA 3.21Å; E127-Y137 HydrophobicContact CB-CD1 3.98Å; E127-Y137 HydrophobicContact CB-CE1 3.93Å; E127-Y137 HydrophobicContact CG-CD1 4.15Å; E127-Y137 HydrophobicContact CG-CE1 3.68Å; E127-Y137 VanDerWaalsContact OE1-CE1 3.29Å; E127-Y137 WeakPolarHBondContact OE1-CE1 3.2Å; E127-Y137 PolarHBondContact OE1-OH 3.19Å; N135-Y137 HydrophobicContact CB-CE2 3.99Å; Y137-Y163 WeakPolarHBondContact O-CA 3.44Å; Y137-I164 HydrophobicContact CG-CD1 4.42Å; Y137-I164 PolarHBondContact O-N 2.82Å; Y137-F187 HydrophobicContact CD2-CB 4.49Å; Y137-F187 HydrophobicContact CD2-CD2 4.18Å; Y137-F187 HydrophobicContact CE2-CB 3.99Å; Y137-F187 HydrophobicContact CE2-CG 4.49Å
138	A	98.6	Very high	91.5	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.008	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	142.8	179.5	0	0	0	0	0	111	F125 V126 R140 Q161 W162 Y163	F125-A138 CarbonylContact C-O 3.56Å; F125-A138 WeakPolarHBondContact CA-O 3.48Å; V126-A138 HydrophobicContact CB-CB 4.46Å; V126-A138 PolarHBondContact N-O 3.31Å; V126-A138 PolarHBondContact O-N 3.28Å; A138-R140 PolarHBondContact O-N 3.02Å; A138-Q161 HydrophobicContact CB-CB 4Å; A138-Q161 HydrophobicContact CB-CG 4.38Å; A138-W162 CarbonylContact C-O 3.54Å; A138-W162 WeakPolarHBondContact CA-O 3.29Å; A138-Y163 HydrophobicContact CB-CD1 3.84Å; A138-Y163 HydrophobicContact CB-CE1 3.73Å
139	S	98.6	Very high	90.5	Very high	7 Å²	7	67.2 Å²	67.2	5%	0.049	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	131.3	168.4	178.4	0	0	0	0	109.6	Q141 H142 W162	S139-Q141 VanDerWaalsContact C-N 3.32Å; S139-Q141 PolarHBondContact OG-N 3.32Å; S139-H142 PolarHBondContact OG-CD2 3.28Å; S139-H142 PolarHBondContact OG-N 3.44Å; S139-W162 PolarHBondContact N-O 2.97Å
140	R	97.9	Very high	89.4	Confident	96 Å²	96	66.9 Å²	66.9	36%	0.362	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	-33.1	172.3	-166.8	-173.2	-172	163.7	6.2	111.7	D90 E124 V126 A138	D90-R140 IonicContact OD2-CZ 3.98Å; D90-R140 IonicContact OD2-NH1 3.69Å; D90-R140 PolarHBondContact OD2-NH1 3.2Å; D90-R140 IonicContact OD2-NH2 3.44Å; D90-R140 PolarHBondContact OD2-NH2 2.99Å; E124-R140 HydrophobicContact CB-CB 4Å; E124-R140 WeakPolarHBondContact O-CB 3.42Å; E124-R140 PolarHBondContact O-N 3.39Å; E124-R140 WeakPolarHBondContact OE2-CD 3.19Å; E124-R140 IonicContact OE2-CZ 3.49Å; E124-R140 IonicContact OE2-NE 2.77Å; E124-R140 IonicContact OE2-NH1 3.43Å; E124-R140 PolarHBondContact OE2-NH1 3.39Å; V126-R140 HydrophobicContact CG2-CB 4.3Å; V126-R140 HydrophobicContact CG2-CG 4.3Å; A138-R140 PolarHBondContact O-N 3.02Å
141	Q	97.5	Very high	88.7	Confident	74 Å²	74	68 Å²	68	35%	0.346	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-29.6	-171.2	-55.1	-56.5	-37.4	0	0	113.2	K121 S139	K121-Q141 HydrophobicContact CB-CG 4.08Å; K121-Q141 WeakPolarHBondContact O-CG 3.38Å; S139-Q141 VanDerWaalsContact C-N 3.32Å; S139-Q141 PolarHBondContact OG-N 3.32Å
142	H	97.8	Very high	88.1	Confident	34 Å²	34	64.8 Å²	64.8	16%	0.157	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.4	-169.2	-53.4	-57.9	0	0	0	113	M107 D109 E122 S139 W162	M107-H142 PolarHBondContact O-CD2 3.25Å; M107-H142 VanDerWaalsContact O-CD2 3.26Å; M107-H142 PolarHBondContact O-NE2 2.77Å; D109-H142 PolarHBondContact N-NE2 3.28Å; E122-H142 IonicContact OE1-NE2 2.7Å; S139-H142 PolarHBondContact OG-CD2 3.28Å; S139-H142 PolarHBondContact OG-N 3.44Å; H142-W162 HydrophobicContact CB-CD2 3.92Å; H142-W162 HydrophobicContact CB-CE3 3.45Å; H142-W162 VanDerWaalsContact CB-CE3 3.45Å; H142-W162 HydrophobicContact CB-CH2 4.43Å; H142-W162 HydrophobicContact CB-CZ3 3.73Å
143	F	96.1	Very high	87	Confident	66 Å²	66	67.3 Å²	67.3	29%	0.289	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	164.9	174.6	58.9	-89.5	0	0	0	109.4	E145 R159 R160	F143-E145 HydrophobicContact CD2-CG 4.1Å; F143-E145 HydrophobicContact CE2-CG 3.63Å; F143-R159 HydrophobicContact CD2-CB 3.8Å; F143-R159 HydrophobicContact CD2-CG 3.6Å; F143-R159 HydrophobicContact CE2-CB 4.36Å; F143-R159 VanDerWaalsContact CE2-CD 3.41Å; F143-R159 HydrophobicContact CE2-CG 3.64Å; F143-R159 VanDerWaalsContact CE2-NE 3.29Å; F143-R159 HydrophobicContact CG-CB 4.25Å; F143-R159 HydrophobicContact CG-CG 4.37Å; F143-R159 HydrophobicContact CZ-CG 4.44Å; F143-R160 CarbonylContact C-O 3.54Å; F143-R160 WeakPolarHBondContact CA-O 3.41Å; F143-R160 WeakPolarHBondContact CB-O 3.35Å
144	T	94.3	Very high	85.6	Confident	53 Å²	53	76.2 Å²	76.2	33%	0.325	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132	170.8	-57.2	0	0	0	0	109.3	R160 W162	T144-R160 PolarHBondContact N-O 3.46Å; T144-R160 PolarHBondContact O-N 3.25Å; T144-W162 PolarHBondContact OG1-NE1 3.48Å
145	E	89.7	Confident	83.8	Confident	111 Å²	111	86 Å²	86	52%	0.519	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128	170.5	-62.5	-171.2	160.9	0	0	109.5	F143	F143-E145 HydrophobicContact CD2-CG 4.1Å; F143-E145 HydrophobicContact CE2-CG 3.63Å
146	Q	80.6	Confident	82	Confident	80 Å²	80	88.6 Å²	88.6	37%	0.374	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132	173.7	-65.8	-164.4	-30.8	0	0	110.3	V148 V158 R160	Q146-V148 PolarHBondContact O-N 3.37Å; Q146-V158 HydrophobicContact CB-CB 4.46Å; Q146-V158 WeakPolarHBondContact CB-O 3.36Å; Q146-V158 PolarHBondContact N-O 3.37Å; Q146-R160 HydrophobicContact CG-CB 4.3Å
147	P	73.1	Confident	80.4	Confident	126 Å²	126	92 Å²	92	82%	0.818	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-58.8	129.2	170.6	-18.6	29.7	0	0	0	109.5
148	V	69.6	Low	79.5	Confident	60 Å²	60	96.2 Å²	96.2	36%	0.364	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-81.9	131.5	174.2	-174.6	0	0	0	0	107.9	Q146 T152	Q146-V148 PolarHBondContact O-N 3.37Å; V148-T152 WeakPolarHBondContact CG1-OG1 3.36Å
149	P	74.9	Confident	78.9	Confident	90 Å²	90	103.1 Å²	103.1	58%	0.584	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-55.7	138.6	176.6	-25.1	33.4	0	0	0	111.8	G151 T152	P149-G151 PolarHBondContact O-N 3.27Å; P149-T152 PolarHBondContact O-OG1 2.67Å
150	P	70.8	Confident	78.6	Confident	137 Å²	137	105.5 Å²	105.5	89%	0.89	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	134.1	174.2	-17.5	28.2	0	0	0	110.4
151	G	72.8	Confident	78.6	Confident	80 Å²	80	103.3 Å²	103.3	83%	0.825	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.9	-5	175.6	0	0	0	0	0	116.4	P149	P149-G151 PolarHBondContact O-N 3.27Å
152	T	71.4	Confident	78.6	Confident	77 Å²	77	101 Å²	101	47%	0.472	53%	0.526	S	S	.	.			trans	-87.5	118.3	172.8	52.6	0	0	0	0	111.2	V148 P149 R154	V148-T152 WeakPolarHBondContact CG1-OG1 3.36Å; P149-T152 PolarHBondContact O-OG1 2.67Å; T152-R154 PolarHBondContact O-N 2.71Å; T152-R154 VanDerWaalsContact O-N 3.11Å
153	K	63.7	Low	78.6	Confident	216 Å²	216	100.3 Å²	100.3	94%	0.939	52%	0.522	S	S	*	.	S	Bend	trans	-71.3	-0.6	-175	-65.9	-176	178.9	179.9	0	114.7
154	R	59.7	Low	78.8	Confident	227 Å²	227	97.2 Å²	97.2	86%	0.857	51%	0.508	S	S	*	.			trans	-109.3	97.6	178.6	-73.1	-172.9	172.2	179.6	-1.7	110.3	T152 A156	T152-R154 PolarHBondContact O-N 2.71Å; T152-R154 VanDerWaalsContact O-N 3.11Å; R154-A156 PolarHBondContact O-N 3.43Å
155	R	57.1	Low	79	Confident	250 Å²	250	94.7 Å²	94.7	94%	0.943	49%	0.493	S	S	*	.			trans	-77.5	77.8	179.1	-70.6	-178.7	174.8	173	-1.8	111.8
156	A	61.5	Low	79.4	Confident	69 Å²	69	89.4 Å²	89.4	57%	0.57	47%	0.468	S	S	*	.			trans	-124.1	116.7	160	0	0	0	0	0	108.5	R154 V158	R154-A156 PolarHBondContact O-N 3.43Å; A156-V158 PolarHBondContact O-N 3.47Å
157	T	64	Low	80.2	Confident	78 Å²	78	87.7 Å²	87.7	48%	0.479	46%	0.461	S	S	.	.			trans	-57.5	119.8	170.4	49.9	0	0	0	0	108.7	R159	T157-R159 PolarHBondContact O-N 2.79Å; T157-R159 VanDerWaalsContact O-N 3.11Å
158	V	79.9	Confident	81.4	Confident	88 Å²	88	84.3 Å²	84.3	53%	0.533	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	107.6	175.8	-179.7	0	0	0	0	107.7	Q146 A156 R160	Q146-V158 HydrophobicContact CB-CB 4.46Å; Q146-V158 WeakPolarHBondContact CB-O 3.36Å; Q146-V158 PolarHBondContact N-O 3.37Å; A156-V158 PolarHBondContact O-N 3.47Å; V158-R160 PolarHBondContact O-N 3.22Å
159	R	86.8	Confident	82.7	Confident	147 Å²	147	89.4 Å²	89.4	56%	0.555	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	114.5	175.5	-68	-175	171.8	-173.7	-3.6	109.6	F143 T157 Q161	F143-R159 HydrophobicContact CD2-CB 3.8Å; F143-R159 HydrophobicContact CD2-CG 3.6Å; F143-R159 HydrophobicContact CE2-CB 4.36Å; F143-R159 VanDerWaalsContact CE2-CD 3.41Å; F143-R159 HydrophobicContact CE2-CG 3.64Å; F143-R159 VanDerWaalsContact CE2-NE 3.29Å; F143-R159 HydrophobicContact CG-CB 4.25Å; F143-R159 HydrophobicContact CG-CG 4.37Å; F143-R159 HydrophobicContact CZ-CG 4.44Å; T157-R159 PolarHBondContact O-N 2.79Å; T157-R159 VanDerWaalsContact O-N 3.11Å; R159-Q161 PolarHBondContact O-N 2.9Å
160	R	92.3	Very high	83.8	Confident	57 Å²	57	85.2 Å²	85.2	22%	0.215	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	105.5	171.6	-175.7	177.1	176.5	-138.4	-8.1	109.7	F143 T144 Q146 V158 F176 T178	F143-R160 CarbonylContact C-O 3.54Å; F143-R160 WeakPolarHBondContact CA-O 3.41Å; F143-R160 WeakPolarHBondContact CB-O 3.35Å; T144-R160 PolarHBondContact N-O 3.46Å; T144-R160 PolarHBondContact O-N 3.25Å; Q146-R160 HydrophobicContact CG-CB 4.3Å; V158-R160 PolarHBondContact O-N 3.22Å; R160-F176 VanDerWaalsContact CZ-O 3.25Å; R160-F176 PolarHBondContact NH1-O 3.28Å; R160-F176 PolarHBondContact NH2-O 2.89Å; R160-F176 VanDerWaalsContact NH2-O 3.16Å; R160-T178 PolarHBondContact NH2-O 3.4Å
161	Q	96.3	Very high	85.1	Confident	50 Å²	50	86.9 Å²	86.9	23%	0.234	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	152.6	176.9	-70.6	175.6	-11.6	0	0	112.5	A138 R159 Y163	A138-Q161 HydrophobicContact CB-CB 4Å; A138-Q161 HydrophobicContact CB-CG 4.38Å; R159-Q161 PolarHBondContact O-N 2.9Å; Q161-Y163 HydrophobicContact CB-CE1 4.43Å; Q161-Y163 HydrophobicContact CB-CE2 3.8Å; Q161-Y163 WeakPolarHBondContact O-CE2 3.42Å; Q161-Y163 PolarHBondContact OE1-OH 3.3Å
162	W	98.2	Very high	86.4	Confident	25 Å²	25	85.5 Å²	85.5	10%	0.095	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127	177	-69.2	11.5	0	0	0	110.2	M107 D109 A138 S139 H142 T144 G175 F176	M107-W162 HydrophobicContact SD-CB 3.9Å; M107-W162 HydrophobicContact SD-CE3 4.11Å; D109-W162 WeakPolarHBondContact O-CH2 3.31Å; D109-W162 VanDerWaalsContact O-CZ3 3.29Å; D109-W162 WeakPolarHBondContact O-CZ3 3.4Å; A138-W162 CarbonylContact C-O 3.54Å; A138-W162 WeakPolarHBondContact CA-O 3.29Å; S139-W162 PolarHBondContact N-O 2.97Å; H142-W162 HydrophobicContact CB-CD2 3.92Å; H142-W162 HydrophobicContact CB-CE3 3.45Å; H142-W162 VanDerWaalsContact CB-CE3 3.45Å; H142-W162 HydrophobicContact CB-CH2 4.43Å; H142-W162 HydrophobicContact CB-CZ3 3.73Å; T144-W162 PolarHBondContact OG1-NE1 3.48Å; W162-G175 WeakPolarHBondContact CA-O 3.4Å; W162-F176 HydrophobicContact CD2-CB 3.95Å; W162-F176 VanDerWaalsContact CE2-CB 3.44Å; W162-F176 HydrophobicContact CG-CB 4.33Å; W162-F176 HydrophobicContact CH2-CB 4.38Å; W162-F176 HydrophobicContact CH2-CD1 4.23Å; W162-F176 HydrophobicContact CZ2-CB 3.69Å; W162-F176 HydrophobicContact CZ2-CD1 4.34Å; W162-F176 HydrophobicContact CZ2-CG 4.44Å; W162-F176 HydrophobicContact CZ3-CD1 4.46Å
163	Y	98.7	Very high	87.6	Confident	20 Å²	20	85.6 Å²	85.6	8%	0.078	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	142.4	-170.9	-60	-91.5	0	0	0	112.9	Y137 A138 Q161 S165 T178	Y137-Y163 WeakPolarHBondContact O-CA 3.44Å; A138-Y163 HydrophobicContact CB-CD1 3.84Å; A138-Y163 HydrophobicContact CB-CE1 3.73Å; Q161-Y163 HydrophobicContact CB-CE1 4.43Å; Q161-Y163 HydrophobicContact CB-CE2 3.8Å; Q161-Y163 WeakPolarHBondContact O-CE2 3.42Å; Q161-Y163 PolarHBondContact OE1-OH 3.3Å; Y163-S165 PolarHBondContact O-N 3.38Å; Y163-T178 PolarHBondContact N-OG1 3.04Å; Y163-T178 PolarHBondContact O-OG1 3.06Å
164	I	98.8	Very high	89.3	Confident	1 Å²	1	79.8 Å²	79.8	1%	0.005	37%	0.369	C	S	.	.			trans	-54.1	134.8	160.2	-69.5	163.1	0	0	0	107.6	L63 I96 L105 M107 L113 F125 Y137 F187	L63-I164 HydrophobicContact CD2-CG2 4.46Å; I96-I164 HydrophobicContact CD1-CD1 4.09Å; L105-I164 HydrophobicContact CD2-CD1 3.41Å; L105-I164 VanDerWaalsContact CD2-CD1 3.41Å; L105-I164 HydrophobicContact CD2-CG1 4.04Å; L105-I164 HydrophobicContact CD2-CG2 4.23Å; L105-I164 HydrophobicContact CG-CD1 4.26Å; M107-I164 HydrophobicContact CE-CG1 4.37Å; L113-I164 HydrophobicContact CD1-CG2 4.05Å; L113-I164 HydrophobicContact CD2-CG1 3.95Å; F125-I164 HydrophobicContact CB-CD1 4.4Å; F125-I164 HydrophobicContact CD1-CD1 3.4Å; F125-I164 HydrophobicContact CD1-CG1 3.84Å; F125-I164 HydrophobicContact CD2-CD1 3.83Å; F125-I164 HydrophobicContact CE1-CD1 3.47Å; F125-I164 VanDerWaalsContact CE1-CD1 3.47Å; F125-I164 HydrophobicContact CE1-CG1 3.62Å; F125-I164 HydrophobicContact CE2-CD1 3.88Å; F125-I164 HydrophobicContact CG-CD1 3.59Å; F125-I164 HydrophobicContact CZ-CD1 3.71Å; F125-I164 HydrophobicContact CZ-CG1 4.13Å; Y137-I164 HydrophobicContact CG-CD1 4.42Å; Y137-I164 PolarHBondContact O-N 2.82Å; I164-F187 HydrophobicContact CG2-CE2 3.95Å; I164-F187 HydrophobicContact CG2-CZ 3.89Å; I164-F187 WeakPolarHBondContact O-CE2 3.2Å
165	S	98.5	Very high	91.1	Very high	0 Å²	0	69 Å²	69	0%	0	33%	0.328	C	S	.	.			trans	-159.1	144.3	-178.8	54.8	0	0	0	0	114.4	Y163 P172 R173 T178 A184	Y163-S165 PolarHBondContact O-N 3.38Å; S165-P172 VanDerWaalsContact O-CA 3.3Å; S165-P172 WeakPolarHBondContact O-CA 3.42Å; S165-R173 PolarHBondContact O-N 2.88Å; S165-R173 VanDerWaalsContact O-N 3.1Å; S165-R173 WeakPolarHBondContact OG-CB 3.32Å; S165-T178 WeakPolarHBondContact OG-CG2 3.21Å; S165-A184 CarbonylContact C-O 3.52Å; S165-A184 WeakPolarHBondContact CA-O 3.2Å; S165-A184 WeakPolarHBondContact CB-O 3.48Å
166	I	98.4	Very high	93	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-125.7	121.5	175.8	-59.3	-66.1	0	0	0	108.6	T59 Y61 L63 P172 A184 F187	T59-I166 WeakPolarHBondContact CG2-O 3.48Å; T59-I166 PolarHBondContact OG1-O 3.07Å; Y61-I166 HydrophobicContact CG-CG2 4.49Å; L63-I166 HydrophobicContact CD1-CD1 3.61Å; L63-I166 HydrophobicContact CD1-CG1 3.78Å; I166-P172 HydrophobicContact CD1-CB 4.1Å; I166-A184 PolarHBondContact N-O 2.59Å; I166-A184 WeakPolarHBondContact O-CA 3.35Å; I166-A184 WeakPolarHBondContact O-CB 3.44Å; I166-F187 HydrophobicContact CG1-CE1 4.26Å; I166-F187 HydrophobicContact CG1-CZ 4.19Å
167	N	97.9	Very high	94.6	Very high	43 Å²	43	62.3 Å²	62.3	23%	0.23	29%	0.294	C	S	.	.			trans	-74.1	176.3	-178.1	72.2	16.1	0	0	0	112.7	K169 G170 R171 R173	N167-K169 PolarHBondContact O-N 3.41Å; N167-K169 WeakPolarHBondContact OD1-CA 3.38Å; N167-K169 WeakPolarHBondContact OD1-CB 3.02Å; N167-K169 PolarHBondContact OD1-N 3.31Å; N167-G170 PolarHBondContact O-N 3.26Å; N167-G170 PolarHBondContact OD1-N 2.81Å; N167-R171 VanDerWaalsContact CG-O 3.27Å; N167-R171 PolarHBondContact N-O 3.28Å; N167-R171 PolarHBondContact OD1-N 2.93Å; N167-R171 PolarHBondContact OD1-O 2.84Å; N167-R173 HydrophobicContact CB-CG 3.92Å
168	G	97.6	Very high	96.1	Very high	55 Å²	55	58.6 Å²	58.6	57%	0.567	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-4.3	178	0	0	0	0	0	115.7	Y61	Y61-G168 WeakPolarHBondContact CE2-O 3.46Å; Y61-G168 PolarHBondContact OH-O 3.01Å
169	K	98	Very high	96.8	Very high	167 Å²	167	60.5 Å²	60.5	73%	0.726	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	13.1	174.6	-56.2	-176.7	179.2	-175.8	0	112	N167 R171	N167-K169 PolarHBondContact O-N 3.41Å; N167-K169 WeakPolarHBondContact OD1-CA 3.38Å; N167-K169 WeakPolarHBondContact OD1-CB 3.02Å; N167-K169 PolarHBondContact OD1-N 3.31Å; K169-R171 VanDerWaalsContact C-N 3.25Å; K169-R171 PolarHBondContact O-N 2.94Å
170	G	97.9	Very high	97.2	Very high	3 Å²	3	55.4 Å²	55.4	3%	0.031	26%	0.255	C	S	.	.	S	Bend	trans	71.7	11.1	-177.6	0	0	0	0	0	114.6	D72 G73 N167	D72-G170 CarbonylContact C-O 3.45Å; D72-G170 WeakPolarHBondContact CA-O 3.4Å; D72-G170 WeakPolarHBondContact CB-O 2.9Å; G73-G170 PolarHBondContact N-O 3.48Å; N167-G170 PolarHBondContact O-N 3.26Å; N167-G170 PolarHBondContact OD1-N 2.81Å
171	R	98.4	Very high	97.3	Very high	171 Å²	171	57.3 Å²	57.3	65%	0.645	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-99.8	142.1	-177.3	-61.2	-176.4	-177.2	-178.2	-0.6	112.1	N167 K169	N167-R171 VanDerWaalsContact CG-O 3.27Å; N167-R171 PolarHBondContact N-O 3.28Å; N167-R171 PolarHBondContact OD1-N 2.93Å; N167-R171 PolarHBondContact OD1-O 2.84Å; K169-R171 VanDerWaalsContact C-N 3.25Å; K169-R171 PolarHBondContact O-N 2.94Å
172	P	98.4	Very high	97.4	Very high	52 Å²	52	57 Å²	57	34%	0.338	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-65.7	143.1	176	28.7	-35.2	0	0	0	111.3	I71 L113 S165 I166	I71-P172 WeakPolarHBondContact O-CD 3.48Å; I71-P172 WeakPolarHBondContact O-CG 3.19Å; L113-P172 HydrophobicContact CB-CB 4.47Å; L113-P172 HydrophobicContact CD1-CB 4.01Å; S165-P172 VanDerWaalsContact O-CA 3.3Å; S165-P172 WeakPolarHBondContact O-CA 3.42Å; I166-P172 HydrophobicContact CD1-CB 4.1Å
173	R	98.3	Very high	97.3	Very high	78 Å²	78	63 Å²	63	29%	0.294	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-103.5	160.2	172.1	-53.3	174.9	67.1	-149	-2.7	110.6	S165 N167 K177 T178 D182	S165-R173 PolarHBondContact O-N 2.88Å; S165-R173 VanDerWaalsContact O-N 3.1Å; S165-R173 WeakPolarHBondContact OG-CB 3.32Å; N167-R173 HydrophobicContact CB-CG 3.92Å; R173-K177 PolarHBondContact NH2-O 2.82Å; R173-T178 HydrophobicContact CB-CG2 3.94Å; R173-D182 IonicContact NH1-OD2 3.46Å; R173-D182 PolarHBondContact NH1-OD2 3.48Å
174	R	98.4	Very high	97.3	Very high	94 Å²	94	62.6 Å²	62.6	36%	0.355	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-71.1	133.8	172.5	-63	-167.9	-171.6	-171.1	7.3	110.6	G111 R112 F176 K177	G111-R174 CarbonylContact O-C 3.54Å; G111-R174 WeakPolarHBondContact O-CA 3.13Å; R112-R174 HydrophobicContact CG-CG 4.43Å; R112-R174 VanDerWaalsContact NH2-NH2 3.16Å; R174-F176 VanDerWaalsContact C-N 3.34Å; R174-F176 HydrophobicContact CB-CD1 4.07Å; R174-F176 HydrophobicContact CB-CE1 3.76Å; R174-F176 HydrophobicContact CB-CZ 4.08Å; R174-F176 VanDerWaalsContact CD-CE1 3.42Å; R174-F176 VanDerWaalsContact CD-CZ 3.45Å; R174-F176 HydrophobicContact CG-CE1 4.23Å; R174-F176 HydrophobicContact CG-CZ 4.44Å; R174-F176 PolarHBondContact O-N 3.12Å; R174-K177 HydrophobicContact CB-CG 4.31Å; R174-K177 WeakPolarHBondContact O-CB 3.01Å; R174-K177 PolarHBondContact O-N 2.95Å
175	G	97.9	Very high	97.3	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-57.2	-38.8	-174.2	0	0	0	0	0	114.6	G111 W162 K177 T178	G111-G175 PolarHBondContact O-N 2.99Å; W162-G175 WeakPolarHBondContact CA-O 3.4Å; G175-K177 PolarHBondContact O-N 3.29Å; G175-K177 VanDerWaalsContact O-N 3.16Å; G175-T178 PolarHBondContact O-N 3.13Å; G175-T178 PolarHBondContact O-OG1 2.79Å
176	F	96.4	Very high	97.3	Very high	59 Å²	59	63.5 Å²	63.5	26%	0.259	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-67.7	-13.8	176.1	63.5	-99.2	0	0	0	114.5	K110 R160 W162 R174	K110-F176 VanDerWaalsContact O-CE1 3.32Å; K110-F176 WeakPolarHBondContact O-CE1 3.29Å; R160-F176 VanDerWaalsContact CZ-O 3.25Å; R160-F176 PolarHBondContact NH1-O 3.28Å; R160-F176 PolarHBondContact NH2-O 2.89Å; R160-F176 VanDerWaalsContact NH2-O 3.16Å; W162-F176 HydrophobicContact CD2-CB 3.95Å; W162-F176 VanDerWaalsContact CE2-CB 3.44Å; W162-F176 HydrophobicContact CG-CB 4.33Å; W162-F176 HydrophobicContact CH2-CB 4.38Å; W162-F176 HydrophobicContact CH2-CD1 4.23Å; W162-F176 HydrophobicContact CZ2-CB 3.69Å; W162-F176 HydrophobicContact CZ2-CD1 4.34Å; W162-F176 HydrophobicContact CZ2-CG 4.44Å; W162-F176 HydrophobicContact CZ3-CD1 4.46Å; R174-F176 VanDerWaalsContact C-N 3.34Å; R174-F176 HydrophobicContact CB-CD1 4.07Å; R174-F176 HydrophobicContact CB-CE1 3.76Å; R174-F176 HydrophobicContact CB-CZ 4.08Å; R174-F176 VanDerWaalsContact CD-CE1 3.42Å; R174-F176 VanDerWaalsContact CD-CZ 3.45Å; R174-F176 HydrophobicContact CG-CE1 4.23Å; R174-F176 HydrophobicContact CG-CZ 4.44Å; R174-F176 PolarHBondContact O-N 3.12Å
177	K	96.2	Very high	97.3	Very high	121 Å²	121	63.5 Å²	63.5	53%	0.526	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-93	0.6	177.5	-61.2	-167.8	174.9	-170.2	0	112.9	R173 R174 G175	R173-K177 PolarHBondContact NH2-O 2.82Å; R174-K177 HydrophobicContact CB-CG 4.31Å; R174-K177 WeakPolarHBondContact O-CB 3.01Å; R174-K177 PolarHBondContact O-N 2.95Å; G175-K177 PolarHBondContact O-N 3.29Å; G175-K177 VanDerWaalsContact O-N 3.16Å
178	T	94.9	Very high	97.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.309	C	S	.	.			trans	-113.9	164.9	-174.9	62.1	0	0	0	0	112.2	R160 Y163 S165 R173 G175 D182	R160-T178 PolarHBondContact NH2-O 3.4Å; Y163-T178 PolarHBondContact N-OG1 3.04Å; Y163-T178 PolarHBondContact O-OG1 3.06Å; S165-T178 WeakPolarHBondContact OG-CG2 3.21Å; R173-T178 HydrophobicContact CB-CG2 3.94Å; G175-T178 PolarHBondContact O-N 3.13Å; G175-T178 PolarHBondContact O-OG1 2.79Å; T178-D182 WeakPolarHBondContact CA-OD2 3.28Å
179	R	95.1	Very high	97.2	Very high	128 Å²	128	63 Å²	63	48%	0.483	29%	0.291	S	S	.	.			trans	-134	161.1	176.2	-60.1	-179.8	-179.3	-92.7	2.7	109.4	T181 D182 S185	R179-T181 PolarHBondContact O-N 3.47Å; R179-D182 PolarHBondContact N-OD2 2.94Å; R179-D182 WeakPolarHBondContact O-CB 3.3Å; R179-D182 PolarHBondContact O-N 2.9Å; R179-S185 WeakPolarHBondContact O-CB 3.28Å; R179-S185 PolarHBondContact O-OG 3.24Å
180	S	94.9	Very high	97.1	Very high	40 Å²	40	59.3 Å²	59.3	28%	0.28	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-30	175.1	48	0	0	0	0	112.7	L186	S180-L186 VanDerWaalsContact O-CD2 3.28Å; S180-L186 WeakPolarHBondContact O-CD2 3.35Å
181	T	94.9	Very high	96.9	Very high	97 Å²	97	64 Å²	64	60%	0.595	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-10.1	-180	53.5	0	0	0	0	113.8	R179 K183	R179-T181 PolarHBondContact O-N 3.47Å; T181-K183 PolarHBondContact O-N 3.45Å
182	D	96.8	Very high	96.7	Very high	42 Å²	42	56.3 Å²	56.3	23%	0.225	27%	0.272	C	S	.	.	S	Bend	trans	-67.9	129.8	178.2	-71.7	-6.9	0	0	0	109.2	R173 T178 R179 A184 S185 L186	R173-D182 IonicContact NH1-OD2 3.46Å; R173-D182 PolarHBondContact NH1-OD2 3.48Å; T178-D182 WeakPolarHBondContact CA-OD2 3.28Å; R179-D182 PolarHBondContact N-OD2 2.94Å; R179-D182 WeakPolarHBondContact O-CB 3.3Å; R179-D182 PolarHBondContact O-N 2.9Å; D182-A184 PolarHBondContact O-N 3.22Å; D182-S185 WeakPolarHBondContact O-CB 3.37Å; D182-S185 PolarHBondContact O-N 2.77Å; D182-L186 PolarHBondContact O-N 3Å
183	K	97.6	Very high	96.5	Very high	153 Å²	153	55.6 Å²	55.6	67%	0.665	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-50.3	-33.2	170.9	-70.1	-177.5	178.9	178.4	0	112.7	C57 A58 T59 T181 S185 L186	C57-K183 PolarHBondContact SG-O 3.19Å; A58-K183 HydrophobicContact CB-CB 4.2Å; A58-K183 WeakPolarHBondContact CB-O 3.4Å; T59-K183 HydrophobicContact CG2-CB 4.38Å; T181-K183 PolarHBondContact O-N 3.45Å; K183-S185 PolarHBondContact O-N 2.61Å; K183-L186 PolarHBondContact O-N 3.12Å
184	A	98.3	Very high	96.4	Very high	10 Å²	10	59 Å²	59	8%	0.083	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-65.6	-19.4	177.8	0	0	0	0	0	114	C57 T59 S165 I166 D182	C57-A184 PolarHBondContact SG-O 2.66Å; T59-A184 HydrophobicContact CG2-CB 4.14Å; S165-A184 CarbonylContact C-O 3.52Å; S165-A184 WeakPolarHBondContact CA-O 3.2Å; S165-A184 WeakPolarHBondContact CB-O 3.48Å; I166-A184 PolarHBondContact N-O 2.59Å; I166-A184 WeakPolarHBondContact O-CA 3.35Å; I166-A184 WeakPolarHBondContact O-CB 3.44Å; D182-A184 PolarHBondContact O-N 3.22Å
185	S	98.4	Very high	96.3	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-102.9	-4.6	-178.8	-50.8	0	0	0	0	113.3	R179 D182 K183 F187	R179-S185 WeakPolarHBondContact O-CB 3.28Å; R179-S185 PolarHBondContact O-OG 3.24Å; D182-S185 WeakPolarHBondContact O-CB 3.37Å; D182-S185 PolarHBondContact O-N 2.77Å; K183-S185 PolarHBondContact O-N 2.61Å; S185-F187 WeakPolarHBondContact O-CD2 3.49Å
186	L	98.4	Very high	96.2	Very high	20 Å²	20	60.9 Å²	60.9	11%	0.105	31%	0.309	C	S	.	.			trans	-95.2	119.9	-177.5	-63	-178.8	0	0	0	109.9	C57 A58 H130 Y134 T136 S180 D182 K183	C57-L186 CarbonylContact C-O 3.54Å; C57-L186 VanDerWaalsContact CA-O 3.31Å; C57-L186 WeakPolarHBondContact CA-O 3.26Å; A58-L186 HydrophobicContact CB-CB 3.97Å; A58-L186 PolarHBondContact N-O 3.4Å; H130-L186 HydrophobicContact CB-CD2 4.23Å; H130-L186 WeakPolarHBondContact CD2-CD2 3.39Å; Y134-L186 HydrophobicContact CD1-CB 3.76Å; Y134-L186 HydrophobicContact CE1-CB 4.47Å; Y134-L186 HydrophobicContact CG-CB 4.11Å; T136-L186 HydrophobicContact CG2-CD2 3.71Å; S180-L186 VanDerWaalsContact O-CD2 3.28Å; S180-L186 WeakPolarHBondContact O-CD2 3.35Å; D182-L186 PolarHBondContact O-N 3Å; K183-L186 PolarHBondContact O-N 3.12Å
187	F	98.6	Very high	96.1	Very high	1 Å²	1	61.8 Å²	61.8	0%	0.004	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.9	-179.4	-65.3	-93.4	0	0	0	111.5	L55 Y56 C57 L63 N135 Y137 I164 I166 S185 P189	L55-F187 HydrophobicContact CB-CB 4.41Å; L55-F187 HydrophobicContact CB-CD1 3.99Å; Y56-F187 CarbonylContact O-C 3.48Å; Y56-F187 WeakPolarHBondContact O-CA 3.33Å; C57-F187 HydrophobicContact CB-CD1 3.81Å; C57-F187 HydrophobicContact CB-CE1 3.61Å; C57-F187 HydrophobicContact CB-CZ 4.31Å; L63-F187 HydrophobicContact CB-CE1 4.28Å; N135-F187 PolarHBondContact N-O 3.12Å; N135-F187 PolarHBondContact O-N 2.94Å; Y137-F187 HydrophobicContact CD2-CB 4.49Å; Y137-F187 HydrophobicContact CD2-CD2 4.18Å; Y137-F187 HydrophobicContact CE2-CB 3.99Å; Y137-F187 HydrophobicContact CE2-CG 4.49Å; I164-F187 HydrophobicContact CG2-CE2 3.95Å; I164-F187 HydrophobicContact CG2-CZ 3.89Å; I164-F187 WeakPolarHBondContact O-CE2 3.2Å; I166-F187 HydrophobicContact CG1-CE1 4.26Å; I166-F187 HydrophobicContact CG1-CZ 4.19Å; S185-F187 WeakPolarHBondContact O-CD2 3.49Å; F187-P189 WeakPolarHBondContact O-CD 3.47Å
188	L	97.8	Very high	96.1	Very high	58 Å²	58	60.7 Å²	60.7	30%	0.304	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	115.4	171.2	-179.6	64.3	0	0	0	109.4	Y56 G133 Y134 R190	Y56-L188 PolarHBondContact N-O 3.22Å; Y56-L188 PolarHBondContact O-N 3.35Å; G133-L188 VanDerWaalsContact O-CD1 3.29Å; G133-L188 WeakPolarHBondContact O-CD1 3.38Å; Y134-L188 HydrophobicContact CD1-CB 4Å; Y134-L188 HydrophobicContact CE1-CB 3.86Å; L188-R190 HydrophobicContact CD2-CG 4.36Å; L188-R190 HydrophobicContact CG-CG 4.36Å; L188-R190 PolarHBondContact O-N 2.74Å; L188-R190 VanDerWaalsContact O-N 3.09Å
189	P	96.3	Very high	96.2	Very high	29 Å²	29	62.6 Å²	62.6	19%	0.188	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	100.1	175.5	-12.3	29.2	0	0	0	110.4	R53 L55 N135 F187	R53-P189 HydrophobicContact CB-CB 4.44Å; R53-P189 HydrophobicContact CG-CB 4.32Å; L55-P189 HydrophobicContact CD2-CB 4.23Å; L55-P189 HydrophobicContact CD2-CG 4.39Å; N135-P189 HydrophobicContact CB-CG 4.43Å; F187-P189 WeakPolarHBondContact O-CD 3.47Å
190	R	95.4	Very high	96.2	Very high	89 Å²	89	56.7 Å²	56.7	34%	0.336	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	138.2	179	-67.7	-177.5	66.2	-166.8	-7.7	111.2	R53 K54 H62 E77 L188	R53-R190 VanDerWaalsContact CA-O 3.29Å; R53-R190 WeakPolarHBondContact CA-O 3.39Å; R53-R190 WeakPolarHBondContact CB-O 3.48Å; R53-R190 WeakPolarHBondContact CD-O 3.5Å; K54-R190 HydrophobicContact CB-CB 4.48Å; K54-R190 PolarHBondContact N-O 2.69Å; K54-R190 PolarHBondContact O-N 3.23Å; H62-R190 PolarHBondContact NE2-NH1 2.94Å; E77-R190 IonicContact OE1-CZ 3.97Å; E77-R190 IonicContact OE1-NH1 2.67Å; E77-R190 PolarHBondContact OE1-NH1 3.26Å; E77-R190 IonicContact OE1-NH2 3.37Å; E77-R190 PolarHBondContact OE1-NH2 2.7Å; L188-R190 HydrophobicContact CD2-CG 4.36Å; L188-R190 HydrophobicContact CG-CG 4.36Å; L188-R190 PolarHBondContact O-N 2.74Å; L188-R190 VanDerWaalsContact O-N 3.09Å
191	V	93.6	Very high	96.3	Very high	101 Å²	101	62.9 Å²	62.9	61%	0.612	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-64.9	148.1	168.2	-176.7	0	0	0	0	109.1
192	L	94.6	Very high	96.3	Very high	11 Å²	11	63.5 Å²	63.5	6%	0.058	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-70.1	139.9	178.5	-63.7	-166.5	0	0	0	110.9	R52 K54 I83 D196 H197 V200	R52-L192 HydrophobicContact CB-CD1 3.79Å; R52-L192 HydrophobicContact CB-CG 4.35Å; K54-L192 HydrophobicContact CG-CD2 3.88Å; I83-L192 HydrophobicContact CG1-CD2 4.29Å; I83-L192 HydrophobicContact CG2-CD1 3.97Å; I83-L192 HydrophobicContact CG2-CD2 4.18Å; L192-D196 HydrophobicContact CB-CB 3.82Å; L192-D196 HydrophobicContact CD1-CB 4.28Å; L192-D196 HydrophobicContact CD2-CB 4.2Å; L192-D196 HydrophobicContact CG-CB 4.31Å; L192-H197 PolarHBondContact O-NE2 2.7Å; L192-V200 HydrophobicContact CD1-CG2 4.22Å
193	G	93.9	Very high	96.1	Very high	36 Å²	36	62.9 Å²	62.9	37%	0.371	31%	0.306	S	S	.	.			trans	-82.3	176.2	172.7	0	0	0	0	0	112.6	K195 D196 H197	G193-K195 VanDerWaalsContact C-N 3.35Å; G193-K195 PolarHBondContact O-N 3.07Å; G193-D196 PolarHBondContact N-OD2 2.84Å; G193-D196 VanDerWaalsContact N-OD2 3.12Å; G193-D196 WeakPolarHBondContact O-CB 3.38Å; G193-D196 PolarHBondContact O-N 3.45Å; G193-D196 VanDerWaalsContact O-N 3.12Å; G193-H197 PolarHBondContact O-CD2 2.99Å; G193-H197 VanDerWaalsContact O-CD2 3.22Å; G193-H197 PolarHBondContact O-N 3.31Å
194	N	95.5	Very high	95.8	Very high	149 Å²	149	62.2 Å²	62.2	80%	0.797	30%	0.299	S	S	*	.	H	α-helix	trans	-57.3	-44.9	-179.9	-67.7	-13.2	0	0	0	112.8	D196 H197 E198	N194-D196 VanDerWaalsContact C-N 3.3Å; N194-D196 PolarHBondContact O-N 3.48Å; N194-H197 PolarHBondContact O-N 2.87Å; N194-E198 PolarHBondContact O-N 2.63Å
195	K	95.7	Very high	95.5	Very high	126 Å²	126	67.1 Å²	67.1	55%	0.548	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-38.1	177.3	-68.5	-178.6	176.2	-178.8	0	112.2	N78 G193 E198 M199	N78-K195 WeakPolarHBondContact OD1-CD 3.49Å; G193-K195 VanDerWaalsContact C-N 3.35Å; G193-K195 PolarHBondContact O-N 3.07Å; K195-E198 WeakPolarHBondContact O-CB 3.31Å; K195-E198 PolarHBondContact O-N 2.73Å; K195-M199 WeakPolarHBondContact O-CG 3.33Å; K195-M199 PolarHBondContact O-N 2.99Å
196	D	95.9	Very high	95	Very high	8 Å²	8	71.7 Å²	71.7	4%	0.043	35%	0.348	C	S	.	.	H	α-helix	trans	-65.6	-44.6	176.3	-62.9	-35.3	0	0	0	111.5	K54 I83 L192 G193 N194 E198 M199 V200	K54-D196 VanDerWaalsContact CE-CG 3.48Å; K54-D196 WeakPolarHBondContact CE-OD1 3.44Å; K54-D196 WeakPolarHBondContact CE-OD2 3.49Å; K54-D196 IonicContact NZ-OD1 2.77Å; K54-D196 PolarHBondContact NZ-OD1 3.09Å; K54-D196 IonicContact NZ-OD2 3.73Å; K54-D196 PolarHBondContact NZ-OD2 2.96Å; I83-D196 HydrophobicContact CD1-CB 3.82Å; L192-D196 HydrophobicContact CB-CB 3.82Å; L192-D196 HydrophobicContact CD1-CB 4.28Å; L192-D196 HydrophobicContact CD2-CB 4.2Å; L192-D196 HydrophobicContact CG-CB 4.31Å; G193-D196 PolarHBondContact N-OD2 2.84Å; G193-D196 VanDerWaalsContact N-OD2 3.12Å; G193-D196 WeakPolarHBondContact O-CB 3.38Å; G193-D196 PolarHBondContact O-N 3.45Å; G193-D196 VanDerWaalsContact O-N 3.12Å; N194-D196 VanDerWaalsContact C-N 3.3Å; N194-D196 PolarHBondContact O-N 3.48Å; D196-E198 VanDerWaalsContact C-N 3.27Å; D196-E198 PolarHBondContact O-N 3.31Å; D196-M199 HydrophobicContact CB-CE 4.47Å; D196-M199 PolarHBondContact O-N 3.23Å; D196-M199 WeakPolarHBondContact OD1-CE 3.38Å; D196-V200 WeakPolarHBondContact O-CB 3.43Å; D196-V200 WeakPolarHBondContact O-CG2 3.35Å; D196-V200 PolarHBondContact O-N 2.87Å
197	H	95.5	Very high	94.3	Very high	78 Å²	78	75.6 Å²	75.6	36%	0.361	37%	0.365	S	S	.	.	H	α-helix	trans	-60	-38.3	175	-77.9	-64.2	0	0	0	112.2	L192 G193 N194 V200 R201	L192-H197 PolarHBondContact O-NE2 2.7Å; G193-H197 PolarHBondContact O-CD2 2.99Å; G193-H197 VanDerWaalsContact O-CD2 3.22Å; G193-H197 PolarHBondContact O-N 3.31Å; N194-H197 PolarHBondContact O-N 2.87Å; H197-V200 PolarHBondContact O-N 2.77Å; H197-R201 WeakPolarHBondContact O-CG 3.46Å; H197-R201 PolarHBondContact O-N 3.34Å
198	E	96.8	Very high	93.4	Very high	98 Å²	98	77.2 Å²	77.2	46%	0.458	38%	0.382	S	S	.	.	H	α-helix	trans	-62.7	-49.7	174.6	-167.1	-168.8	155.3	0	0	111.8	N194 K195 D196 V200 R201 K202	N194-E198 PolarHBondContact O-N 2.63Å; K195-E198 WeakPolarHBondContact O-CB 3.31Å; K195-E198 PolarHBondContact O-N 2.73Å; D196-E198 VanDerWaalsContact C-N 3.27Å; D196-E198 PolarHBondContact O-N 3.31Å; E198-V200 PolarHBondContact O-N 2.92Å; E198-R201 PolarHBondContact O-N 2.79Å; E198-K202 WeakPolarHBondContact O-CG 3.4Å; E198-K202 PolarHBondContact O-N 3.16Å; E198-K202 WeakPolarHBondContact OE1-CE 3.34Å; E198-K202 IonicContact OE1-NZ 3.55Å; E198-K202 PolarHBondContact OE1-NZ 3.28Å
199	M	96.4	Very high	92.5	Very high	41 Å²	41	77.3 Å²	77.3	20%	0.202	39%	0.391	C	S	.	.	H	α-helix	trans	-57	-42.4	176.3	-68.8	-172.1	-74.8	0	0	111.4	P80 I83 F100 K195 D196 K202 L203	P80-M199 HydrophobicContact CB-SD 3.94Å; P80-M199 HydrophobicContact CG-SD 4.31Å; I83-M199 HydrophobicContact CD1-CE 3.98Å; F100-M199 HydrophobicContact CE1-CB 4.48Å; F100-M199 HydrophobicContact CZ-CB 3.77Å; F100-M199 WeakPolarHBondContact CZ-O 3.15Å; K195-M199 WeakPolarHBondContact O-CG 3.33Å; K195-M199 PolarHBondContact O-N 2.99Å; D196-M199 HydrophobicContact CB-CE 4.47Å; D196-M199 PolarHBondContact O-N 3.23Å; D196-M199 WeakPolarHBondContact OD1-CE 3.38Å; M199-K202 PolarHBondContact O-N 2.92Å; M199-L203 PolarHBondContact O-N 3.17Å
200	V	95.4	Very high	91.3	Very high	4 Å²	4	82.2 Å²	82.2	2%	0.024	41%	0.412	C	S	.	.	H	α-helix	trans	-66.8	-37.2	179.8	167.6	0	0	0	0	112.7	I83 L99 F100 L192 D196 H197 E198 R204	I83-V200 HydrophobicContact CD1-CG2 4.05Å; I83-V200 HydrophobicContact CG2-CG2 4.08Å; L99-V200 HydrophobicContact CD2-CG1 4.17Å; L99-V200 HydrophobicContact CD2-CG2 3.7Å; F100-V200 HydrophobicContact CE2-CG2 4.2Å; L192-V200 HydrophobicContact CD1-CG2 4.22Å; D196-V200 WeakPolarHBondContact O-CB 3.43Å; D196-V200 WeakPolarHBondContact O-CG2 3.35Å; D196-V200 PolarHBondContact O-N 2.87Å; H197-V200 PolarHBondContact O-N 2.77Å; E198-V200 PolarHBondContact O-N 2.92Å; V200-R204 PolarHBondContact O-N 2.89Å
201	R	95.3	Very high	90.1	Very high	169 Å²	169	84.7 Å²	84.7	64%	0.638	43%	0.427	S	S	*	.	H	α-helix	trans	-64.1	-50	173.4	-74.6	174.4	-170.5	170.1	2.7	110.3	H197 E198 L203 R204 D205	H197-R201 WeakPolarHBondContact O-CG 3.46Å; H197-R201 PolarHBondContact O-N 3.34Å; E198-R201 PolarHBondContact O-N 2.79Å; R201-L203 VanDerWaalsContact C-N 3.28Å; R201-L203 PolarHBondContact O-N 2.92Å; R201-R204 WeakPolarHBondContact O-CB 3.37Å; R201-R204 PolarHBondContact O-N 3.21Å; R201-D205 VanDerWaalsContact O-CG 3.31Å; R201-D205 PolarHBondContact O-N 3.45Å
202	K	95.3	Very high	89.1	Confident	110 Å²	110	83.6 Å²	83.6	48%	0.478	42%	0.42	S	S	.	.	H	α-helix	trans	-54.9	-42.4	177.2	-69.7	177.5	-176.9	171.4	0	112.4	E198 M199 R204 D205 I206	E198-K202 WeakPolarHBondContact O-CG 3.4Å; E198-K202 PolarHBondContact O-N 3.16Å; E198-K202 WeakPolarHBondContact OE1-CE 3.34Å; E198-K202 IonicContact OE1-NZ 3.55Å; E198-K202 PolarHBondContact OE1-NZ 3.28Å; M199-K202 PolarHBondContact O-N 2.92Å; K202-R204 VanDerWaalsContact C-N 3.34Å; K202-R204 PolarHBondContact O-N 3.43Å; K202-D205 PolarHBondContact O-N 2.98Å; K202-I206 WeakPolarHBondContact O-CD1 3.44Å; K202-I206 VanDerWaalsContact O-CG1 3.29Å; K202-I206 WeakPolarHBondContact O-CG1 3.18Å; K202-I206 PolarHBondContact O-N 2.8Å
203	L	93.5	Very high	87.8	Confident	29 Å²	29	89.9 Å²	89.9	15%	0.152	45%	0.449	C	S	.	.	H	α-helix	trans	-59.5	-43.2	176.3	-178.3	65.9	0	0	0	112.2	L99 F100 M199 R201 Q207	L99-L203 HydrophobicContact CD2-CD2 4.45Å; L99-L203 HydrophobicContact CG-CD2 3.99Å; F100-L203 HydrophobicContact CD1-CD1 4.19Å; F100-L203 HydrophobicContact CD1-CD2 4.02Å; F100-L203 HydrophobicContact CD2-CD2 4.29Å; F100-L203 HydrophobicContact CE1-CB 3.93Å; F100-L203 HydrophobicContact CE1-CD1 4.28Å; F100-L203 HydrophobicContact CE1-CD2 4.01Å; F100-L203 HydrophobicContact CE1-CG 4.3Å; F100-L203 HydrophobicContact CE2-CD2 4.26Å; F100-L203 HydrophobicContact CG-CD2 4.16Å; F100-L203 HydrophobicContact CZ-CB 4.13Å; F100-L203 HydrophobicContact CZ-CD2 4.11Å; M199-L203 PolarHBondContact O-N 3.17Å; R201-L203 VanDerWaalsContact C-N 3.28Å; R201-L203 PolarHBondContact O-N 2.92Å; L203-Q207 WeakPolarHBondContact O-CG 3.31Å; L203-Q207 PolarHBondContact O-N 2.96Å; L203-Q207 VanDerWaalsContact O-N 3.1Å
204	R	91	Very high	86.6	Confident	139 Å²	139	93.1 Å²	93.1	53%	0.525	45%	0.454	S	S	.	.	H	α-helix	trans	-66.1	-41	178.2	-73.3	174.3	165.1	-178.7	-4.4	111.7	R52 V200 R201 K202 Q207 G208	R52-R204 VanDerWaalsContact NH2-NH2 3.18Å; V200-R204 PolarHBondContact O-N 2.89Å; R201-R204 WeakPolarHBondContact O-CB 3.37Å; R201-R204 PolarHBondContact O-N 3.21Å; K202-R204 VanDerWaalsContact C-N 3.34Å; K202-R204 PolarHBondContact O-N 3.43Å; R204-Q207 PolarHBondContact O-N 2.86Å; R204-G208 PolarHBondContact O-N 2.78Å
205	D	92.1	Very high	85.3	Confident	113 Å²	113	92.2 Å²	92.2	60%	0.604	45%	0.445	S	S	*	.	H	α-helix	trans	-63.6	-43.2	179.7	-60.1	-25.2	0	0	0	110.9	R201 K202 G208 A209	R201-D205 VanDerWaalsContact O-CG 3.31Å; R201-D205 PolarHBondContact O-N 3.45Å; K202-D205 PolarHBondContact O-N 2.98Å; D205-G208 PolarHBondContact O-N 2.84Å; D205-A209 WeakPolarHBondContact O-CB 3.08Å; D205-A209 PolarHBondContact O-N 3.32Å
206	I	88.1	Confident	84	Confident	97 Å²	97	92.4 Å²	92.4	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-59.8	-48.7	174.8	-67.9	164.3	0	0	0	110.6	K202 G208 A209 H210	K202-I206 WeakPolarHBondContact O-CD1 3.44Å; K202-I206 VanDerWaalsContact O-CG1 3.29Å; K202-I206 WeakPolarHBondContact O-CG1 3.18Å; K202-I206 PolarHBondContact O-N 2.8Å; I206-G208 VanDerWaalsContact C-N 3.34Å; I206-G208 PolarHBondContact O-N 3Å; I206-A209 PolarHBondContact O-N 3.1Å; I206-H210 PolarHBondContact O-CD2 2.88Å; I206-H210 PolarHBondContact O-N 3.32Å; I206-H210 VanDerWaalsContact O-N 3.11Å
207	Q	84.4	Confident	82.7	Confident	101 Å²	101	94.1 Å²	94.1	47%	0.472	47%	0.468	S	S	.	.	H	α-helix	trans	-61.9	-41.4	178.5	-72.2	174.4	-16.1	0	0	112	L203 R204 H210 H211	L203-Q207 WeakPolarHBondContact O-CG 3.31Å; L203-Q207 PolarHBondContact O-N 2.96Å; L203-Q207 VanDerWaalsContact O-N 3.1Å; R204-Q207 PolarHBondContact O-N 2.86Å; Q207-H210 PolarHBondContact O-N 2.91Å; Q207-H211 PolarHBondContact O-CD2 2.9Å; Q207-H211 PolarHBondContact O-N 3.29Å
208	G	79.6	Confident	81.6	Confident	35 Å²	35	97.8 Å²	97.8	36%	0.361	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-40.8	176.1	0	0	0	0	0	113.2	R204 D205 I206 H211 T212	R204-G208 PolarHBondContact O-N 2.78Å; D205-G208 PolarHBondContact O-N 2.84Å; I206-G208 VanDerWaalsContact C-N 3.34Å; I206-G208 PolarHBondContact O-N 3Å; G208-H211 PolarHBondContact O-N 3.29Å; G208-T212 PolarHBondContact O-N 3.32Å; G208-T212 PolarHBondContact O-OG1 3.11Å
209	A	77.9	Confident	80.1	Confident	60 Å²	60	102 Å²	102	50%	0.496	49%	0.49	S	S	.	.	H	α-helix	trans	-62.7	-44.6	176.5	0	0	0	0	0	111.9	D205 I206 H211 T212 H213	D205-A209 WeakPolarHBondContact O-CB 3.08Å; D205-A209 PolarHBondContact O-N 3.32Å; I206-A209 PolarHBondContact O-N 3.1Å; A209-H211 PolarHBondContact O-N 3.02Å; A209-T212 PolarHBondContact O-N 3.43Å; A209-H213 WeakPolarHBondContact O-CB 3.09Å; A209-H213 PolarHBondContact O-N 3.19Å
210	H	72.2	Confident	78.9	Confident	133 Å²	133	101.7 Å²	101.7	62%	0.616	50%	0.497	S	S	*	.	H	α-helix	trans	-59.4	-43.5	175.7	-80	-70	0	0	0	112.5	I206 Q207 T212 H214	I206-H210 PolarHBondContact O-CD2 2.88Å; I206-H210 PolarHBondContact O-N 3.32Å; I206-H210 VanDerWaalsContact O-N 3.11Å; Q207-H210 PolarHBondContact O-N 2.91Å; H210-T212 VanDerWaalsContact C-N 3.35Å; H210-T212 PolarHBondContact O-N 3.16Å; H210-H214 WeakPolarHBondContact O-CB 3.29Å; H210-H214 PolarHBondContact O-N 3.05Å
211	H	70.3	Confident	77.6	Confident	141 Å²	141	106.5 Å²	106.5	65%	0.653	52%	0.52	S	S	*	.	H	α-helix	trans	-62.8	-41	176.4	-79.6	-61.6	0	0	0	112.6	Q207 G208 A209 Q215	Q207-H211 PolarHBondContact O-CD2 2.9Å; Q207-H211 PolarHBondContact O-N 3.29Å; G208-H211 PolarHBondContact O-N 3.29Å; A209-H211 PolarHBondContact O-N 3.02Å; H211-Q215 PolarHBondContact O-N 2.78Å; H211-Q215 VanDerWaalsContact O-N 3.1Å
212	T	71	Confident	76.3	Confident	77 Å²	77	107.1 Å²	107.1	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-67.7	-44.7	-179.3	-50.8	0	0	0	0	111.3	G208 A209 H210 H214 Q215 Q216	G208-T212 PolarHBondContact O-N 3.32Å; G208-T212 PolarHBondContact O-OG1 3.11Å; A209-T212 PolarHBondContact O-N 3.43Å; H210-T212 VanDerWaalsContact C-N 3.35Å; H210-T212 PolarHBondContact O-N 3.16Å; T212-H214 PolarHBondContact O-N 3.46Å; T212-Q215 PolarHBondContact O-N 3.39Å; T212-Q216 PolarHBondContact O-N 3.47Å
213	H	68.9	Low	75.2	Confident	143 Å²	143	111.7 Å²	111.7	66%	0.662	54%	0.536	S	S	*	.	H	α-helix	trans	-62.2	-43.1	177	-171.5	-93.5	0	0	0	111.8	A209 Q215 Q216 G217	A209-H213 WeakPolarHBondContact O-CB 3.09Å; A209-H213 PolarHBondContact O-N 3.19Å; H213-Q215 VanDerWaalsContact C-N 3.34Å; H213-Q215 PolarHBondContact O-N 2.79Å; H213-Q216 PolarHBondContact O-N 2.86Å; H213-G217 PolarHBondContact O-N 2.99Å
214	H	66.9	Low	74.1	Confident	105 Å²	105	119.9 Å²	119.9	49%	0.486	57%	0.565	S	S	.	*	H	α-helix	trans	-62.5	-38.5	176.4	-168.4	-37.4	0	0	0	112.3	H210 T212 R218	H210-H214 WeakPolarHBondContact O-CB 3.29Å; H210-H214 PolarHBondContact O-N 3.05Å; T212-H214 PolarHBondContact O-N 3.46Å; H214-R218 VanDerWaalsContact CE1-CZ 3.45Å; H214-R218 PolarHBondContact CE1-NE 2.84Å; H214-R218 VanDerWaalsContact CE1-NE 3.27Å; H214-R218 PolarHBondContact O-N 2.89Å
215	Q	68.2	Low	73.1	Confident	129 Å²	129	120.8 Å²	120.8	60%	0.603	57%	0.568	S	S	*	*	H	α-helix	trans	-69.8	-40.3	176.4	-85.8	-174.1	-4.6	0	0	112.9	H211 T212 H213 R218 R219	H211-Q215 PolarHBondContact O-N 2.78Å; H211-Q215 VanDerWaalsContact O-N 3.1Å; T212-Q215 PolarHBondContact O-N 3.39Å; H213-Q215 VanDerWaalsContact C-N 3.34Å; H213-Q215 PolarHBondContact O-N 2.79Å; Q215-R218 PolarHBondContact O-N 2.77Å; Q215-R219 WeakPolarHBondContact O-CG 3.28Å; Q215-R219 PolarHBondContact O-N 2.95Å
216	Q	70	Confident	72	Confident	131 Å²	131	124.7 Å²	124.7	61%	0.612	58%	0.575	S	S	*	*	H	α-helix	trans	-64.6	-42.3	176.1	-76.1	-176.5	-7.9	0	0	111.7	T212 H213 R218 R219 G220	T212-Q216 PolarHBondContact O-N 3.47Å; H213-Q216 PolarHBondContact O-N 2.86Å; Q216-R218 PolarHBondContact O-N 2.89Å; Q216-R219 PolarHBondContact O-N 3.16Å; Q216-G220 PolarHBondContact O-N 3.06Å
217	G	68.8	Low	71.2	Confident	44 Å²	44	125.8 Å²	125.8	45%	0.454	58%	0.578	S	S	.	*	H	α-helix	trans	-57.9	-47.1	174	0	0	0	0	0	112.6	H213 R219 G220 E221	H213-G217 PolarHBondContact O-N 2.99Å; G217-R219 PolarHBondContact O-N 2.79Å; G217-G220 PolarHBondContact O-N 3.03Å; G217-E221 PolarHBondContact O-N 3.23Å
218	R	71.4	Confident	70.5	Confident	155 Å²	155	130 Å²	130	59%	0.585	59%	0.589	S	S	*	*	H	α-helix	trans	-62.9	-38.8	175.6	-79.4	-175.5	162.4	165.3	2.5	113.1	H214 Q215 Q216 R222	H214-R218 VanDerWaalsContact CE1-CZ 3.45Å; H214-R218 PolarHBondContact CE1-NE 2.84Å; H214-R218 VanDerWaalsContact CE1-NE 3.27Å; H214-R218 PolarHBondContact O-N 2.89Å; Q215-R218 PolarHBondContact O-N 2.77Å; Q216-R218 PolarHBondContact O-N 2.89Å; R218-R222 WeakPolarHBondContact O-CB 3.28Å; R218-R222 WeakPolarHBondContact O-CG 3.3Å; R218-R222 PolarHBondContact O-N 2.82Å
219	R	66.3	Low	70.1	Confident	187 Å²	187	133.7 Å²	133.7	71%	0.706	60%	0.6	S	S	*	*	H	α-helix	trans	-67.2	-41.1	175.6	-80	-176.6	175.3	-174.4	-0.2	111.7	Q215 Q216 G217 R222 R223	Q215-R219 WeakPolarHBondContact O-CG 3.28Å; Q215-R219 PolarHBondContact O-N 2.95Å; Q216-R219 PolarHBondContact O-N 3.16Å; G217-R219 PolarHBondContact O-N 2.79Å; R219-R222 PolarHBondContact O-N 3.28Å; R219-R223 PolarHBondContact O-N 2.92Å
220	G	69.8	Low	69.5	Low	34 Å²	34	139.2 Å²	139.2	35%	0.351	61%	0.609	S	S	.	*	H	α-helix	trans	-62.1	-44.4	175.5	0	0	0	0	0	112.3	Q216 G217 R223 R224	Q216-G220 PolarHBondContact O-N 3.06Å; G217-G220 PolarHBondContact O-N 3.03Å; G220-R223 PolarHBondContact O-N 3.42Å; G220-R224 PolarHBondContact O-N 2.83Å
221	E	68.8	Low	69.2	Low	105 Å²	105	137.6 Å²	137.6	49%	0.491	60%	0.601	S	S	.	*	H	α-helix	trans	-66.3	-41.3	178.1	-165	-179.7	168.6	0	0	112.4	G217 R223 R224 R225	G217-E221 PolarHBondContact O-N 3.23Å; E221-R223 VanDerWaalsContact C-N 3.33Å; E221-R223 PolarHBondContact O-N 3.49Å; E221-R224 PolarHBondContact O-N 3.37Å; E221-R225 PolarHBondContact O-N 3.09Å; E221-R225 IonicContact OE1-CZ 3.93Å; E221-R225 IonicContact OE1-NE 3.95Å; E221-R225 IonicContact OE1-NH2 3.22Å; E221-R225 PolarHBondContact OE1-NH2 2.77Å
222	R	67.9	Low	68.8	Low	182 Å²	182	132.6 Å²	132.6	69%	0.687	59%	0.587	S	S	*	*	H	α-helix	trans	-60.7	-40.3	172.8	-77	179.4	179.2	-171.3	-0.6	112.4	R218 R219 R226	R218-R222 WeakPolarHBondContact O-CB 3.28Å; R218-R222 WeakPolarHBondContact O-CG 3.3Å; R218-R222 PolarHBondContact O-N 2.82Å; R219-R222 PolarHBondContact O-N 3.28Å; R222-R226 WeakPolarHBondContact O-CG 3.29Å; R222-R226 PolarHBondContact O-N 3.5Å
223	R	71.2	Confident	68.1	Low	206 Å²	206	138 Å²	138	78%	0.777	60%	0.601	S	S	*	*	H	α-helix	trans	-64	-44.2	174.9	-97.5	-176.3	168.6	172.4	-3.7	111.7	R219 G220 E221 R226 H227	R219-R223 PolarHBondContact O-N 2.92Å; G220-R223 PolarHBondContact O-N 3.42Å; E221-R223 VanDerWaalsContact C-N 3.33Å; E221-R223 PolarHBondContact O-N 3.49Å; R223-R226 PolarHBondContact O-N 2.89Å; R223-H227 PolarHBondContact O-N 3.09Å; R223-H227 VanDerWaalsContact O-N 3.09Å
224	R	72.1	Confident	67.7	Low	201 Å²	201	136.5 Å²	136.5	76%	0.758	59%	0.594	S	S	*	*	H	α-helix	trans	-63.7	-41	178.1	-75.3	-179.4	178.9	168.2	-0.3	112.8	G220 E221 H227 R228	G220-R224 PolarHBondContact O-N 2.83Å; E221-R224 PolarHBondContact O-N 3.37Å; R224-H227 PolarHBondContact O-N 3.05Å; R224-R228 PolarHBondContact O-N 3.02Å; R224-R228 VanDerWaalsContact O-N 3.08Å
225	R	68.3	Low	67.3	Low	157 Å²	157	139.6 Å²	139.6	59%	0.592	61%	0.606	S	S	*	*	H	α-helix	trans	-60.2	-49.2	174.5	-75.7	-173.2	-171.1	-175.8	3.9	111.6	E221 H227 R228 D229	E221-R225 PolarHBondContact O-N 3.09Å; E221-R225 IonicContact OE1-CZ 3.93Å; E221-R225 IonicContact OE1-NE 3.95Å; E221-R225 IonicContact OE1-NH2 3.22Å; E221-R225 PolarHBondContact OE1-NH2 2.77Å; R225-H227 VanDerWaalsContact C-N 3.26Å; R225-H227 PolarHBondContact O-N 2.83Å; R225-R228 PolarHBondContact O-N 3.03Å; R225-R228 VanDerWaalsContact O-N 3.07Å; R225-D229 PolarHBondContact O-N 3.29Å
226	R	70.5	Confident	66.7	Low	196 Å²	196	140.9 Å²	140.9	74%	0.74	61%	0.614	S	S	*	*	H	α-helix	trans	-57.7	-36.3	176.7	-73	-178.5	179.4	-164.5	-2	113.5	R222 R223 R230	R222-R226 WeakPolarHBondContact O-CG 3.29Å; R222-R226 PolarHBondContact O-N 3.5Å; R223-R226 PolarHBondContact O-N 2.89Å; R226-R230 WeakPolarHBondContact O-CB 3.49Å; R226-R230 PolarHBondContact O-N 3.05Å; R226-R230 VanDerWaalsContact O-N 3.14Å
227	H	71.8	Confident	66.1	Low	120 Å²	120	138.9 Å²	138.9	56%	0.556	62%	0.615	S	S	*	*	H	α-helix	trans	-67.8	-43.9	176.3	-149	-86.5	0	0	0	111.5	R223 R224 R225 R230 E231	R223-H227 PolarHBondContact O-N 3.09Å; R223-H227 VanDerWaalsContact O-N 3.09Å; R224-H227 PolarHBondContact O-N 3.05Å; R225-H227 VanDerWaalsContact C-N 3.26Å; R225-H227 PolarHBondContact O-N 2.83Å; H227-R230 PolarHBondContact O-N 3.33Å; H227-E231 IonicContact CE1-OE1 3.26Å; H227-E231 PolarHBondContact CE1-OE1 3.46Å; H227-E231 VanDerWaalsContact CE1-OE1 3.26Å; H227-E231 IonicContact ND1-OE1 2.86Å; H227-E231 PolarHBondContact ND1-OE1 2.81Å; H227-E231 PolarHBondContact O-N 3.34Å
228	R	69.4	Low	65.3	Low	188 Å²	188	147.7 Å²	147.7	71%	0.709	63%	0.634	S	S	*	*	H	α-helix	trans	-65.8	-39.7	178.5	-162.7	-177.6	-67.8	-173.8	-3.4	112.4	R224 R225 R230 E231 G232	R224-R228 PolarHBondContact O-N 3.02Å; R224-R228 VanDerWaalsContact O-N 3.08Å; R225-R228 PolarHBondContact O-N 3.03Å; R225-R228 VanDerWaalsContact O-N 3.07Å; R228-R230 VanDerWaalsContact C-N 3.32Å; R228-E231 PolarHBondContact O-N 3.27Å; R228-G232 PolarHBondContact O-N 3.09Å
229	D	70.6	Confident	64.2	Low	113 Å²	113	150.3 Å²	150.3	60%	0.604	66%	0.657	S	S	*	*	H	α-helix	trans	-66.2	-36.6	176.7	-60.4	-25.6	0	0	0	111.1	R225 G232 Y233	R225-D229 PolarHBondContact O-N 3.29Å; D229-G232 PolarHBondContact O-N 3.19Å; D229-Y233 PolarHBondContact O-N 3.43Å
230	R	66.1	Low	64.1	Low	177 Å²	177	148.5 Å²	148.5	67%	0.668	66%	0.655	S	S	*	*	H	α-helix	trans	-69.7	-43.7	176.1	-167.6	178	-175.4	175.5	3.8	112.5	R226 H227 R228 G232 Y233 E234	R226-R230 WeakPolarHBondContact O-CB 3.49Å; R226-R230 PolarHBondContact O-N 3.05Å; R226-R230 VanDerWaalsContact O-N 3.14Å; H227-R230 PolarHBondContact O-N 3.33Å; R228-R230 VanDerWaalsContact C-N 3.32Å; R230-G232 VanDerWaalsContact C-N 3.3Å; R230-G232 PolarHBondContact O-N 2.7Å; R230-Y233 PolarHBondContact O-N 3.4Å; R230-E234 PolarHBondContact O-N 3.01Å
231	E	65.2	Low	63.8	Low	99 Å²	99	154.5 Å²	154.5	46%	0.463	67%	0.671	S	S	.	*	H	α-helix	trans	-62.9	-35.9	173.3	-78.6	171.6	-163	0	0	112.2	H227 R228 K235	H227-E231 IonicContact CE1-OE1 3.26Å; H227-E231 PolarHBondContact CE1-OE1 3.46Å; H227-E231 VanDerWaalsContact CE1-OE1 3.26Å; H227-E231 IonicContact ND1-OE1 2.86Å; H227-E231 PolarHBondContact ND1-OE1 2.81Å; H227-E231 PolarHBondContact O-N 3.34Å; R228-E231 PolarHBondContact O-N 3.27Å; E231-K235 PolarHBondContact O-N 3.37Å; E231-K235 VanDerWaalsContact O-N 3.11Å
232	G	61.2	Low	63.6	Low	35 Å²	35	157.2 Å²	157.2	36%	0.361	68%	0.681	S	S	.	*	H	α-helix	trans	-65	-40.8	173.9	0	0	0	0	0	112.5	R228 D229 R230 K235 M236	R228-G232 PolarHBondContact O-N 3.09Å; D229-G232 PolarHBondContact O-N 3.19Å; R230-G232 VanDerWaalsContact C-N 3.3Å; R230-G232 PolarHBondContact O-N 2.7Å; G232-K235 PolarHBondContact O-N 2.98Å; G232-M236 PolarHBondContact O-N 3.11Å
233	Y	57.5	Low	63.3	Low	191 Å²	191	155.8 Å²	155.8	75%	0.749	68%	0.681	S	S	*	*	H	α-helix	trans	-68.9	-40.2	177.5	-143.8	-88.9	0	0	0	112.4	D229 R230 M236 S237	D229-Y233 PolarHBondContact O-N 3.43Å; R230-Y233 PolarHBondContact O-N 3.4Å; Y233-M236 PolarHBondContact O-N 3.4Å; Y233-S237 PolarHBondContact O-N 3.03Å
234	E	60.2	Low	62.8	Low	111 Å²	111	152.6 Å²	152.6	52%	0.519	68%	0.675	S	S	.	*	H	α-helix	trans	-64.8	-38	175.3	-83.3	172.8	176.3	0	0	112	R230 M236 S237 W238	R230-E234 PolarHBondContact O-N 3.01Å; E234-M236 VanDerWaalsContact C-N 3.32Å; E234-M236 PolarHBondContact O-N 3.26Å; E234-S237 PolarHBondContact O-N 3.44Å; E234-W238 VanDerWaalsContact O-CD1 3.26Å
235	K	58.4	Low	62.2	Low	171 Å²	171	149.4 Å²	149.4	74%	0.743	67%	0.669	S	S	*	*	H	α-helix	trans	-67.9	-27.7	175.5	-82.2	-177	176	-179.8	0	114.3	E231 G232 S237	E231-K235 PolarHBondContact O-N 3.37Å; E231-K235 VanDerWaalsContact O-N 3.11Å; G232-K235 PolarHBondContact O-N 2.98Å; K235-S237 VanDerWaalsContact C-N 3.35Å
236	M	55.8	Low	61.8	Low	155 Å²	155	148.9 Å²	148.9	76%	0.764	68%	0.675	S	S	*	*	H	α-helix	trans	-81.2	-12	176.4	-101.5	151.2	146.8	0	0	113.7	G232 Y233 E234	G232-M236 PolarHBondContact O-N 3.11Å; Y233-M236 PolarHBondContact O-N 3.4Å; E234-M236 VanDerWaalsContact C-N 3.32Å; E234-M236 PolarHBondContact O-N 3.26Å
237	S	56.2	Low	61.1	Low	90 Å²	90	145.2 Å²	145.2	63%	0.629	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	1.7	-179.5	-171.1	0	0	0	0	114.2	Y233 E234 K235	Y233-S237 PolarHBondContact O-N 3.03Å; E234-S237 PolarHBondContact O-N 3.44Å; K235-S237 VanDerWaalsContact C-N 3.35Å
238	W	51.8	Low	60.2	Low	229 Å²	229	147.3 Å²	147.3	87%	0.867	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	22.4	-179.4	-70.6	100.9	0	0	0	113.4	E234	E234-W238 VanDerWaalsContact O-CD1 3.26Å
239	I	50.2	Low	59.4	Low	209 Å²	209	143.6 Å²	143.6	100%	1.072	68%	0.676	S	S	*	*			trans	-119.7	0	168.7	-57	174.9	0	0	0	107

Retrieved 239 of 239 residues in 226.2 ms (Link to these results)

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