A0A060XVY2_ONCMY Loading...

Nucleoside diphosphate kinase

AlphaFold DB , UniProt , Accession A0A060XVY2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110494618, Length 205 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	47	Very low	35.3	Very low	239 Å²	239	178.4 Å²	178.4	100%	1.177	82%	0.819	S	S	*	*				0	117.5	0	-157.5	165.1	80.7	0	0	106.3
2	V	41.5	Very low	35.2	Very low	140 Å²	140	178.7 Å²	178.7	85%	0.848	83%	0.83	S	S	*	*			trans	64.9	108.9	-162.6	-167.9	0	0	0	0	114
3	Q	32.6	Very low	35.1	Very low	167 Å²	167	176.9 Å²	176.9	78%	0.78	83%	0.828	S	S	*	*			trans	179	140.4	138.7	-106.2	-169.1	2.6	0	0	114.2
4	F	35.4	Very low	34.8	Very low	156 Å²	156	175.6 Å²	175.6	68%	0.684	83%	0.828	S	S	*	*			trans	78.8	102.7	153.9	-78.4	-113.3	0	0	0	119
5	Q	33	Very low	34.5	Very low	169 Å²	169	177.4 Å²	177.4	79%	0.79	84%	0.836	S	S	*	*				66.9	108.9	82.5	-84.2	-170.4	-29	0	0	114.6
6	R	37.8	Very low	34.2	Very low	235 Å²	235	173.6 Å²	173.6	89%	0.887	83%	0.834	S	S	*	*			trans	-2.8	130.3	141.4	-65.4	172.7	172.6	-177.2	-3.5	114.3
7	Y	30.6	Very low	34.3	Very low	204 Å²	204	169.5 Å²	169.5	80%	0.8	83%	0.825	S	S	*	*			trans	-178.1	128	133.5	-112.8	-135.2	0	0	0	111.6
8	W	31.6	Very low	34.1	Very low	175 Å²	175	172.6 Å²	172.6	66%	0.663	83%	0.828	S	S	*	*			trans	61.7	103.3	161.6	-57.4	92.8	0	0	0	118.1	K10	W8-K10 HydrophobicContact CE3-CD 3.7Å; W8-K10 HydrophobicContact CE3-CG 4.35Å; W8-K10 HydrophobicContact CZ3-CD 3.94Å; W8-K10 VanDerWaalsContact CZ3-CE 3.43Å
9	L	33	Very low	34	Very low	173 Å²	173	170.1 Å²	170.1	91%	0.906	83%	0.829	S	S	*	*				18.3	85.2	68.1	-105	116.9	0	0	0	114.5
10	K	32	Very low	33.9	Very low	156 Å²	156	174.1 Å²	174.1	68%	0.678	83%	0.834	S	S	*	*			trans	-172.6	142.2	145.1	-102.3	163.3	-173	178.5	0	108.5	W8	W8-K10 HydrophobicContact CE3-CD 3.7Å; W8-K10 HydrophobicContact CE3-CG 4.35Å; W8-K10 HydrophobicContact CZ3-CD 3.94Å; W8-K10 VanDerWaalsContact CZ3-CE 3.43Å
11	N	34.1	Very low	33.7	Very low	148 Å²	148	169 Å²	169	79%	0.791	83%	0.829	S	S	*	*			trans	85.9	88	173.9	-52.6	-34.3	0	0	0	115.8
12	L	33.9	Very low	33	Very low	182 Å²	182	164.7 Å²	164.7	95%	0.953	82%	0.815	S	S	*	*			trans	-158.1	77.1	137.1	-124.4	100.5	0	0	0	109.1
13	I	33.3	Very low	32.4	Very low	156 Å²	156	166.1 Å²	166.1	80%	0.8	82%	0.817	S	S	*	*			trans	-125.1	138.2	156.6	-54.7	-179.5	0	0	0	105.5
14	L	31.1	Very low	32.2	Very low	159 Å²	159	163.9 Å²	163.9	83%	0.832	82%	0.82	S	S	*	*			trans	92.1	101.5	173.5	-53.2	171.7	0	0	0	115.2
15	Q	30.6	Very low	31.9	Very low	202 Å²	202	161 Å²	161	94%	0.944	82%	0.819	S	S	*	*				-172.1	104.8	123.8	-98.9	171.1	32.3	0	0	110
16	S	29.4	Very low	31.9	Very low	116 Å²	116	164.5 Å²	164.5	81%	0.811	83%	0.825	S	S	*	*			trans	-161.2	136.6	137.3	-171.6	0	0	0	0	110.5
17	P	35.4	Very low	31.5	Very low	104 Å²	104	163 Å²	163	68%	0.675	83%	0.825	S	S	*	*			trans	-116.3	123.2	-162.3	34.3	-17	0	0	0	112.3
18	Y	31.1	Very low	31.4	Very low	226 Å²	226	158.2 Å²	158.2	89%	0.886	82%	0.821	S	S	*	*			trans	-146.8	130.3	158.8	-99.9	-83.6	0	0	0	112.6
19	C	32.3	Very low	31.2	Very low	124 Å²	124	160.9 Å²	160.9	84%	0.838	83%	0.833	S	S	*	*			trans	85	104.4	159.1	-61.7	0	0	0	0	119.7
20	R	32.2	Very low	31.4	Very low	250 Å²	250	160.1 Å²	160.1	94%	0.943	83%	0.828	S	S	*	*			trans	-76.3	142	163.5	-70.7	179.1	-178.4	-156.6	-0.6	111.4
21	G	29.9	Very low	31.4	Very low	69 Å²	69	158.2 Å²	158.2	71%	0.711	83%	0.831	S	S	*	*			trans	80.4	121.4	131.5	0	0	0	0	0	119.3
22	V	31.7	Very low	31.3	Very low	147 Å²	147	159.5 Å²	159.5	89%	0.891	83%	0.832	S	S	*	*				174.5	130.9	99.5	160.8	0	0	0	0	108.6
23	L	29	Very low	31.3	Very low	171 Å²	171	161.3 Å²	161.3	90%	0.895	83%	0.833	S	S	*	*			trans	-69.7	141.1	172.1	-76.7	118.4	0	0	0	111.6
24	S	29.6	Very low	31.3	Very low	119 Å²	119	159.2 Å²	159.2	83%	0.832	83%	0.832	S	S	*	*			trans	-160.3	143.5	138.9	-169.1	0	0	0	0	111.9
25	S	29.4	Very low	31.7	Very low	96 Å²	96	160.5 Å²	160.5	67%	0.671	83%	0.831	S	S	*	*			trans	-61.4	146.2	-169.8	61.9	0	0	0	0	115.2
26	R	31.1	Very low	31.8	Very low	242 Å²	242	156.8 Å²	156.8	91%	0.913	83%	0.827	S	S	*	*				-165.9	129.3	115.8	-100.3	163.1	-159.1	-123.8	5.6	110.7
27	K	29.4	Very low	32.4	Very low	205 Å²	205	157.3 Å²	157.3	89%	0.891	82%	0.819	S	S	*	*			trans	-67.1	136.9	169.8	-69	171.5	172.8	177.9	0	109.3
28	S	29.9	Very low	32.6	Very low	102 Å²	102	159.3 Å²	159.3	71%	0.713	82%	0.824	S	S	*	*			trans	-176.5	115.6	131.9	38.2	0	0	0	0	112.6
29	Y	26.6	Very low	32.9	Very low	232 Å²	232	157.6 Å²	157.6	91%	0.91	82%	0.821	S	S	*	*			trans	64.5	113.4	140.2	-74.3	-92.9	0	0	0	121.1
30	I	37.9	Very low	33.1	Very low	157 Å²	157	155 Å²	155	81%	0.805	82%	0.816	S	S	*	*			trans	-73.6	144.5	161.1	-55.2	160.5	0	0	0	107.7
31	P	32.3	Very low	33.3	Very low	115 Å²	115	151.6 Å²	151.6	75%	0.747	81%	0.81	S	S	*	*				-140.9	141.6	104.1	24.3	-3.3	0	0	0	115.3
32	E	31.8	Very low	33.6	Very low	175 Å²	175	159.6 Å²	159.6	82%	0.818	82%	0.819	S	S	*	*			trans	62.2	104.2	144.5	-59	-166.4	170	0	0	120.3	S34	E32-S34 PolarHBondContact O-N 2.97Å
33	F	33.1	Very low	34	Very low	221 Å²	221	158.5 Å²	158.5	97%	0.969	82%	0.816	S	S	*	*			trans	-57.1	96.9	155.8	-100.9	-100.5	0	0	0	110
34	S	33.8	Very low	34.5	Very low	112 Å²	112	154.4 Å²	154.4	78%	0.783	81%	0.807	S	S	*	*			trans	-90.8	121.6	162.2	-158.4	0	0	0	0	109.3	E32 C36	E32-S34 PolarHBondContact O-N 2.97Å; S34-C36 PolarHBondContact O-N 3.1Å; S34-C36 VanDerWaalsContact O-N 3.1Å
35	F	40.1	Very low	34.8	Very low	185 Å²	185	152.4 Å²	152.4	81%	0.811	81%	0.805	S	S	*	*			trans	-67.5	96.9	-177.9	-148.1	-97	0	0	0	109.4	L37	F35-L37 HydrophobicContact CD1-CD1 4.12Å; F35-L37 HydrophobicContact CD1-CG 4.47Å; F35-L37 HydrophobicContact CE1-CD1 4.04Å; F35-L37 HydrophobicContact CE1-CG 4.43Å; F35-L37 PolarHBondContact O-N 3.41Å
36	C	31.6	Very low	35.2	Very low	125 Å²	125	157.5 Å²	157.5	85%	0.845	81%	0.811	S	S	*	*			trans	-95.5	86	174.1	-142.8	0	0	0	0	110	S34	S34-C36 PolarHBondContact O-N 3.1Å; S34-C36 VanDerWaalsContact O-N 3.1Å
37	L	41.7	Very low	35.8	Very low	126 Å²	126	151.1 Å²	151.1	66%	0.66	80%	0.804	S	S	*	*			trans	-60.3	161.9	145.3	-89.6	150.7	0	0	0	109	F35	F35-L37 HydrophobicContact CD1-CD1 4.12Å; F35-L37 HydrophobicContact CD1-CG 4.47Å; F35-L37 HydrophobicContact CE1-CD1 4.04Å; F35-L37 HydrophobicContact CE1-CG 4.43Å; F35-L37 PolarHBondContact O-N 3.41Å
38	L	39.9	Very low	36.4	Very low	147 Å²	147	144.5 Å²	144.5	77%	0.77	78%	0.781	S	S	*	*			trans	90.4	110.2	178.8	-46.7	164.5	0	0	0	110.7
39	F	37.8	Very low	37.3	Very low	189 Å²	189	145.3 Å²	145.3	83%	0.829	78%	0.781	S	S	*	*				-140.2	105.1	51.2	-80.2	-102.4	0	0	0	111.5
40	G	35.6	Very low	38.1	Very low	70 Å²	70	137.7 Å²	137.7	72%	0.722	76%	0.762	S	S	*	*			trans	-76.7	120.7	149.7	0	0	0	0	0	107.1	R42	G40-R42 PolarHBondContact O-N 3.09Å
41	H	37.2	Very low	38.9	Very low	179 Å²	179	133.7 Å²	133.7	83%	0.829	76%	0.759	S	S	*	*			trans	-61.6	92.5	165	-81	-73.3	0	0	0	108	C43	H41-C43 PolarHBondContact O-N 2.79Å; H41-C43 VanDerWaalsContact O-N 3.09Å
42	R	35.8	Very low	40.3	Very low	237 Å²	237	131 Å²	131	89%	0.894	74%	0.738	S	S	*	*			trans	-59.7	107.5	157.4	-97.4	179.6	176.3	-139.3	-0.7	105.7	G40 A44	G40-R42 PolarHBondContact O-N 3.09Å; R42-A44 VanDerWaalsContact C-N 3.28Å; R42-A44 PolarHBondContact O-N 2.91Å
43	C	39.7	Very low	41.8	Very low	124 Å²	124	128 Å²	128	84%	0.838	73%	0.734	S	S	*	*			trans	-56.7	104.2	154.8	-67.3	0	0	0	0	105.7	H41 G45	H41-C43 PolarHBondContact O-N 2.79Å; H41-C43 VanDerWaalsContact O-N 3.09Å; C43-G45 PolarHBondContact O-N 2.85Å
44	A	39.3	Very low	43.4	Very low	85 Å²	85	118.9 Å²	118.9	70%	0.702	70%	0.702	S	S	*	*			trans	-60.7	111.9	175.1	0	0	0	0	0	107	R42 Y46	R42-A44 VanDerWaalsContact C-N 3.28Å; R42-A44 PolarHBondContact O-N 2.91Å; A44-Y46 PolarHBondContact O-N 2.91Å
45	G	37.4	Very low	45.6	Very low	77 Å²	77	114.4 Å²	114.4	79%	0.794	67%	0.67	S	S	*	*			trans	-62	99.2	172.6	0	0	0	0	0	108.8	C43 S47	C43-G45 PolarHBondContact O-N 2.85Å; G45-S47 VanDerWaalsContact C-N 3.26Å; G45-S47 PolarHBondContact O-N 3.12Å
46	Y	36.9	Very low	48	Very low	202 Å²	202	111.4 Å²	111.4	79%	0.792	65%	0.653	S	S	*	*			trans	-71.4	92.2	161.2	-118.4	-97.8	0	0	0	106.4	A44 T48	A44-Y46 PolarHBondContact O-N 2.91Å; Y46-T48 HydrophobicContact CD1-CG2 3.63Å; Y46-T48 HydrophobicContact CE1-CG2 4.1Å; Y46-T48 PolarHBondContact O-N 3.42Å
47	S	44.3	Very low	51	Low	108 Å²	108	107.1 Å²	107.1	76%	0.755	62%	0.621	S	S	*	*			trans	-72	81	163.7	-175.2	0	0	0	0	107.7	G45	G45-S47 VanDerWaalsContact C-N 3.26Å; G45-S47 PolarHBondContact O-N 3.12Å
48	T	42.2	Very low	53.7	Low	66 Å²	66	104.4 Å²	104.4	41%	0.405	60%	0.602	S	S	.	*			trans	-108.5	82.1	161	45.7	0	0	0	0	106.7	Y46 S50	Y46-T48 HydrophobicContact CD1-CG2 3.63Å; Y46-T48 HydrophobicContact CE1-CG2 4.1Å; Y46-T48 PolarHBondContact O-N 3.42Å; T48-S50 PolarHBondContact O-N 3.18Å
49	T	48.6	Very low	56.5	Low	119 Å²	119	97.4 Å²	97.4	73%	0.73	57%	0.565	S	S	*	*			trans	-66.5	76.8	152.4	50.2	0	0	0	0	107.2	G51	T49-G51 VanDerWaalsContact C-N 3.28Å; T49-G51 PolarHBondContact O-N 2.93Å
50	S	43.9	Very low	59.4	Low	73 Å²	73	88.4 Å²	88.4	51%	0.51	53%	0.526	S	S	.	.			trans	-60.6	100.7	157.2	44.5	0	0	0	0	105.5	T48 I52	T48-S50 PolarHBondContact O-N 3.18Å; S50-I52 VanDerWaalsContact C-N 3.32Å; S50-I52 PolarHBondContact O-N 3.04Å
51	G	54.8	Low	62.4	Low	72 Å²	72	85.1 Å²	85.1	74%	0.742	49%	0.492	S	S	*	.			trans	-68.8	80	-163.8	0	0	0	0	0	113.3	T49 P53	T49-G51 VanDerWaalsContact C-N 3.28Å; T49-G51 PolarHBondContact O-N 2.93Å; G51-P53 VanDerWaalsContact O-CD 3.23Å; G51-P53 WeakPolarHBondContact O-CD 3.47Å
52	I	61	Low	65.3	Low	59 Å²	59	76.7 Å²	76.7	30%	0.303	45%	0.453	S	S	.	.			trans	-75.6	112.1	160.9	-59.2	174.7	0	0	0	106.4	S50 G54 V55 Y133 Y203	S50-I52 VanDerWaalsContact C-N 3.32Å; S50-I52 PolarHBondContact O-N 3.04Å; I52-G54 PolarHBondContact O-N 3.05Å; I52-V55 HydrophobicContact CB-CG2 3.64Å; I52-V55 HydrophobicContact CG2-CG2 3.79Å; I52-V55 WeakPolarHBondContact O-CG2 3.19Å; I52-Y133 HydrophobicContact CG2-CD2 3.82Å; I52-Y133 HydrophobicContact CG2-CE2 3.74Å; I52-Y203 WeakPolarHBondContact CD1-O 3.29Å
53	P	62.6	Low	68.3	Low	111 Å²	111	65.4 Å²	65.4	72%	0.721	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	138.7	175.1	-19.8	33.2	0	0	0	109.7	G51 Y133	G51-P53 VanDerWaalsContact O-CD 3.23Å; G51-P53 WeakPolarHBondContact O-CD 3.47Å; P53-Y133 WeakPolarHBondContact O-CD2 3.39Å; P53-Y133 VanDerWaalsContact O-CE2 3.28Å; P53-Y133 WeakPolarHBondContact O-CE2 2.94Å
54	G	66.8	Low	71.1	Confident	30 Å²	30	60.3 Å²	60.3	31%	0.309	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	-6.8	176	0	0	0	0	0	116.1	I52 R56 E57 G132 Y133	I52-G54 PolarHBondContact O-N 3.05Å; G54-R56 PolarHBondContact O-N 3.48Å; G54-R56 VanDerWaalsContact O-N 3.14Å; G54-E57 WeakPolarHBondContact O-CB 3.45Å; G54-E57 PolarHBondContact O-N 3.01Å; G54-G132 CarbonylContact O-C 3.5Å; G54-Y133 WeakPolarHBondContact O-CA 3.41Å
55	V	80.7	Confident	74	Confident	18 Å²	18	56.2 Å²	56.2	11%	0.109	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.4	175.3	176.3	0	0	0	0	112.8	I52 G132 Y133 Y203	I52-V55 HydrophobicContact CB-CG2 3.64Å; I52-V55 HydrophobicContact CG2-CG2 3.79Å; I52-V55 WeakPolarHBondContact O-CG2 3.19Å; V55-G132 CarbonylContact O-C 3.57Å; V55-G132 WeakPolarHBondContact O-CA 3.42Å; V55-Y133 HydrophobicContact CG2-CD2 4.41Å; V55-Y203 HydrophobicContact CG1-CD1 4.22Å; V55-Y203 HydrophobicContact CG1-CD2 4.16Å; V55-Y203 HydrophobicContact CG1-CE1 4.29Å; V55-Y203 HydrophobicContact CG1-CE2 4.23Å; V55-Y203 HydrophobicContact CG1-CG 4.15Å; V55-Y203 HydrophobicContact CG2-CD1 3.96Å; V55-Y203 HydrophobicContact CG2-CE1 4.34Å; V55-Y203 HydrophobicContact CG2-CG 4.41Å
56	R	89.4	Confident	76.8	Confident	122 Å²	122	53 Å²	53	46%	0.46	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	10.8	175.2	-62.3	-66.5	-168	152.9	2.4	113.3	G54 K86 E131 D193	G54-R56 PolarHBondContact O-N 3.48Å; G54-R56 VanDerWaalsContact O-N 3.14Å; R56-K86 VanDerWaalsContact NH1-NZ 3.19Å; R56-E131 WeakPolarHBondContact CD-OE1 3.44Å; R56-E131 IonicContact CZ-OE1 3.35Å; R56-E131 IonicContact NE-OE1 3.77Å; R56-E131 IonicContact NH1-OE1 3.7Å; R56-E131 PolarHBondContact NH1-OE1 2.92Å; R56-D193 IonicContact CZ-OD1 3.16Å; R56-D193 IonicContact NH1-OD1 2.73Å; R56-D193 PolarHBondContact NH1-OD1 3.23Å
57	E	95.9	Very high	79.8	Confident	35 Å²	35	43.4 Å²	43.4	16%	0.164	27%	0.268	C	S	.	.			trans	-60.2	143.1	173.3	-176.2	-177.6	98.9	0	0	109.6	G54 E131 G132 N134 V135 V136 V175	G54-E57 WeakPolarHBondContact O-CB 3.45Å; G54-E57 PolarHBondContact O-N 3.01Å; E57-E131 CarbonylContact O-C 3.53Å; E57-E131 VanDerWaalsContact O-CA 3.25Å; E57-E131 WeakPolarHBondContact O-CA 3.22Å; E57-G132 PolarHBondContact O-N 2.86Å; E57-N134 WeakPolarHBondContact OE1-CA 3.37Å; E57-V135 HydrophobicContact CB-CG1 4.21Å; E57-V135 HydrophobicContact CG-CG1 4.01Å; E57-V135 VanDerWaalsContact O-CG1 3.28Å; E57-V135 WeakPolarHBondContact O-CG1 3.38Å; E57-V135 PolarHBondContact OE1-N 3.07Å; E57-V136 HydrophobicContact CG-CG2 4.05Å; E57-V136 WeakPolarHBondContact OE1-CB 3.45Å; E57-V136 WeakPolarHBondContact OE1-CG2 3.27Å; E57-V136 PolarHBondContact OE1-N 3.39Å; E57-V175 WeakPolarHBondContact OE2-CG2 3.22Å
58	R	98.1	Very high	82.3	Confident	70 Å²	70	39.3 Å²	39.3	26%	0.264	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.7	179.3	-65.3	-179.7	179.7	-175.2	-3.7	111	V129 W130 E131 A178 I182	R58-V129 HydrophobicContact CB-CG1 4.09Å; R58-V129 HydrophobicContact CG-CG1 4.43Å; R58-W130 CarbonylContact C-O 3.59Å; R58-W130 WeakPolarHBondContact CA-O 3.4Å; R58-E131 HydrophobicContact CG-CB 3.99Å; R58-E131 HydrophobicContact CG-CG 4.1Å; R58-E131 IonicContact CZ-OE2 2.95Å; R58-E131 IonicContact NE-OE2 3.95Å; R58-E131 PolarHBondContact NE-OE2 3.07Å; R58-E131 IonicContact NH2-OE2 3.88Å; R58-E131 PolarHBondContact NH2-OE2 2.94Å; R58-A178 WeakPolarHBondContact O-CB 3.42Å; R58-I182 HydrophobicContact CB-CD1 3.64Å
59	T	98.6	Very high	85	Confident	0 Å²	0	42 Å²	42	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.5	173.4	-168.6	0	0	0	0	111.1	V61 V129 W130 V135 S139	T59-V61 HydrophobicContact CG2-CG2 4.14Å; T59-V129 WeakPolarHBondContact O-CA 3.45Å; T59-W130 HydrophobicContact CG2-CB 4.11Å; T59-W130 PolarHBondContact N-O 2.8Å; T59-W130 PolarHBondContact O-N 3.01Å; T59-W130 VanDerWaalsContact O-N 3.07Å; T59-V135 HydrophobicContact CG2-CB 4.38Å; T59-V135 HydrophobicContact CG2-CG1 4Å; T59-V135 HydrophobicContact CG2-CG2 3.68Å; T59-S139 WeakPolarHBondContact CG2-OG 3.34Å
60	L	98.7	Very high	87.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	130.5	170.6	-170.8	119.8	0	0	0	109.5	V127 A171 S172 E181 I182 W185 F186	L60-V127 HydrophobicContact CD1-CG1 3.67Å; L60-V127 HydrophobicContact CD2-CG1 4.06Å; L60-V127 HydrophobicContact CG-CG1 3.91Å; L60-A171 VanDerWaalsContact O-CA 3.29Å; L60-A171 WeakPolarHBondContact O-CA 3.49Å; L60-S172 WeakPolarHBondContact CB-OG 3.45Å; L60-S172 PolarHBondContact N-OG 3.08Å; L60-S172 VanDerWaalsContact N-OG 3.13Å; L60-S172 PolarHBondContact O-N 3.14Å; L60-S172 VanDerWaalsContact O-N 3.09Å; L60-S172 PolarHBondContact O-OG 2.9Å; L60-E181 HydrophobicContact CB-CB 3.99Å; L60-E181 HydrophobicContact CD1-CB 4.28Å; L60-E181 HydrophobicContact CD2-CB 4.15Å; L60-E181 HydrophobicContact CG-CB 4.36Å; L60-I182 HydrophobicContact CB-CG1 4.1Å; L60-I182 HydrophobicContact CD1-CG1 4.27Å; L60-W185 HydrophobicContact CD1-CB 3.75Å; L60-W185 HydrophobicContact CD1-CG 3.88Å; L60-F186 HydrophobicContact CD1-CD2 4.38Å; L60-F186 HydrophobicContact CD1-CE2 4.28Å
61	V	98.7	Very high	89.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.2	173.4	178.7	0	0	0	0	108	T59 F80 M128 V169 H170 A171	T59-V61 HydrophobicContact CG2-CG2 4.14Å; V61-F80 HydrophobicContact CB-CZ 4.49Å; V61-F80 HydrophobicContact CG1-CE2 4.34Å; V61-F80 HydrophobicContact CG1-CZ 4.03Å; V61-F80 HydrophobicContact CG2-CE1 3.66Å; V61-F80 HydrophobicContact CG2-CZ 3.74Å; V61-M128 HydrophobicContact CG1-CE 4.19Å; V61-M128 PolarHBondContact N-O 2.93Å; V61-M128 PolarHBondContact O-N 3.22Å; V61-V169 HydrophobicContact CG1-CG2 3.69Å; V61-H170 CarbonylContact C-O 3.58Å; V61-H170 WeakPolarHBondContact CA-O 3.31Å; V61-A171 HydrophobicContact CG2-CB 4.23Å
62	A	98.6	Very high	92	Very high	3 Å²	3	46 Å²	46	3%	0.025	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	122.6	178	0	0	0	0	0	111.4	K64 V126 V127 V169 H170	A62-K64 PolarHBondContact O-N 3.06Å; A62-V126 CarbonylContact C-O 3.56Å; A62-V126 VanDerWaalsContact CA-O 3.29Å; A62-V126 WeakPolarHBondContact CA-O 3.41Å; A62-V127 HydrophobicContact CB-CG1 4.41Å; A62-V127 HydrophobicContact CB-CG2 4.37Å; A62-V169 CarbonylContact O-C 3.55Å; A62-V169 WeakPolarHBondContact O-CA 3.33Å; A62-H170 HydrophobicContact CB-CB 4.26Å; A62-H170 PolarHBondContact N-O 2.94Å; A62-H170 PolarHBondContact O-N 3.08Å
63	V	98.7	Very high	93.8	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119.8	168.1	-172.9	0	0	0	0	107.8	V68 V73 I76 I125 V126 M128	V63-V68 HydrophobicContact CB-CG2 4.37Å; V63-V68 HydrophobicContact CG1-CG2 3.98Å; V63-V73 HydrophobicContact CG1-CG2 4.25Å; V63-I76 HydrophobicContact CB-CD1 4.33Å; V63-I76 HydrophobicContact CG1-CD1 3.76Å; V63-I76 HydrophobicContact CG2-CB 4.34Å; V63-I76 HydrophobicContact CG2-CD1 3.7Å; V63-I76 HydrophobicContact CG2-CG2 4.17Å; V63-I125 WeakPolarHBondContact O-CA 3.26Å; V63-I125 WeakPolarHBondContact O-CB 3.3Å; V63-V126 HydrophobicContact CB-CB 4.2Å; V63-V126 HydrophobicContact CG2-CB 4.42Å; V63-V126 PolarHBondContact N-O 3.23Å; V63-V126 PolarHBondContact O-N 3.07Å; V63-V126 VanDerWaalsContact O-N 3.12Å; V63-M128 HydrophobicContact CG2-CE 3.81Å
64	K	98.5	Very high	95.5	Very high	16 Å²	16	42 Å²	42	7%	0.07	20%	0.201	C	C	.	.			trans	-75.4	168.6	-176.7	-63.3	-174.6	-179.5	-177.2	0	111.1	A62 D66 G67 V68 Y119 M120 N167 V168	A62-K64 PolarHBondContact O-N 3.06Å; K64-D66 VanDerWaalsContact CB-OD1 3.27Å; K64-D66 WeakPolarHBondContact CB-OD1 2.96Å; K64-D66 PolarHBondContact O-N 3.49Å; K64-D66 VanDerWaalsContact O-N 3.17Å; K64-G67 PolarHBondContact O-N 2.85Å; K64-V68 PolarHBondContact O-N 3.16Å; K64-V68 VanDerWaalsContact O-N 3.1Å; K64-Y119 WeakPolarHBondContact CB-OH 3.12Å; K64-Y119 HydrophobicContact CD-CE1 3.81Å; K64-M120 HydrophobicContact CB-SD 4.25Å; K64-M120 HydrophobicContact CD-SD 4.03Å; K64-M120 HydrophobicContact CG-CE 4.39Å; K64-M120 HydrophobicContact CG-SD 3.86Å; K64-N167 PolarHBondContact NZ-OD1 3.04Å; K64-V168 WeakPolarHBondContact CB-O 3.44Å; K64-V168 PolarHBondContact N-O 3.29Å
65	P	98.6	Very high	97	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-56.6	-35.8	-174.7	-30.2	39.5	0	0	0	114.3	V68 Q69 Y119 P124 I125	P65-V68 PolarHBondContact O-N 3.4Å; P65-Q69 WeakPolarHBondContact O-CB 3.44Å; P65-Q69 WeakPolarHBondContact O-CG 3.17Å; P65-Q69 PolarHBondContact O-N 3.02Å; P65-Y119 HydrophobicContact CB-CE2 4.31Å; P65-Y119 HydrophobicContact CG-CD2 4.47Å; P65-Y119 HydrophobicContact CG-CE2 4.31Å; P65-P124 WeakPolarHBondContact CA-O 3.5Å; P65-I125 HydrophobicContact CG-CG2 3.83Å
66	D	98.2	Very high	97.9	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.053	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-42.5	175.5	64.9	-27.2	0	0	0	112.5	K64 V68 Q69 R70 Y119 R166 V168	K64-D66 VanDerWaalsContact CB-OD1 3.27Å; K64-D66 WeakPolarHBondContact CB-OD1 2.96Å; K64-D66 PolarHBondContact O-N 3.49Å; K64-D66 VanDerWaalsContact O-N 3.17Å; D66-V68 VanDerWaalsContact C-N 3.33Å; D66-V68 PolarHBondContact O-N 3.42Å; D66-Q69 PolarHBondContact O-N 3.23Å; D66-R70 VanDerWaalsContact O-CB 3.25Å; D66-R70 WeakPolarHBondContact O-CB 3.48Å; D66-R70 WeakPolarHBondContact O-CD 3.47Å; D66-R70 WeakPolarHBondContact O-CG 3.48Å; D66-R70 PolarHBondContact O-N 3.21Å; D66-Y119 HydrophobicContact CB-CE2 4.43Å; D66-Y119 PolarHBondContact OD1-OH 3.29Å; D66-Y119 PolarHBondContact OD2-OH 3.31Å; D66-R166 WeakPolarHBondContact OD2-CA 3.47Å; D66-V168 WeakPolarHBondContact OD1-CA 3.43Å; D66-V168 WeakPolarHBondContact OD2-CA 3.34Å; D66-V168 PolarHBondContact OD2-N 3.02Å; D66-V168 VanDerWaalsContact OD2-N 3.07Å
67	G	98.3	Very high	98.3	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.8	-40.4	176.3	0	0	0	0	0	112.1	K64 R71 L72	K64-G67 PolarHBondContact O-N 2.85Å; G67-R71 PolarHBondContact O-N 3.33Å; G67-L72 WeakPolarHBondContact O-CB 3.41Å; G67-L72 PolarHBondContact O-N 3.44Å
68	V	98.4	Very high	98.4	Very high	22 Å²	22	41.2 Å²	41.2	13%	0.133	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-49.5	175.6	-179.3	0	0	0	0	111.2	V63 K64 P65 D66 R70 R71 V73 M92 P124 V126	V63-V68 HydrophobicContact CB-CG2 4.37Å; V63-V68 HydrophobicContact CG1-CG2 3.98Å; K64-V68 PolarHBondContact O-N 3.16Å; K64-V68 VanDerWaalsContact O-N 3.1Å; P65-V68 PolarHBondContact O-N 3.4Å; D66-V68 VanDerWaalsContact C-N 3.33Å; D66-V68 PolarHBondContact O-N 3.42Å; V68-R70 PolarHBondContact O-N 3.14Å; V68-R71 PolarHBondContact O-N 2.86Å; V68-V73 HydrophobicContact CG2-CG2 4.04Å; V68-M92 HydrophobicContact CG1-CE 3.74Å; V68-P124 HydrophobicContact CG1-CG 3.94Å; V68-P124 WeakPolarHBondContact CG2-O 3.46Å; V68-V126 HydrophobicContact CG2-CG2 4.01Å
69	Q	97.8	Very high	98.4	Very high	121 Å²	121	40.5 Å²	40.5	57%	0.565	19%	0.192	S	C	*	.	H	α-helix	trans	-59.6	-32.4	178.8	-73.3	171.1	12.9	0	0	112.6	P65 D66 R71	P65-Q69 WeakPolarHBondContact O-CB 3.44Å; P65-Q69 WeakPolarHBondContact O-CG 3.17Å; P65-Q69 PolarHBondContact O-N 3.02Å; D66-Q69 PolarHBondContact O-N 3.23Å; Q69-R71 VanDerWaalsContact C-N 3.29Å; Q69-R71 PolarHBondContact O-N 3Å
70	R	98.1	Very high	98.4	Very high	116 Å²	116	40.5 Å²	40.5	44%	0.438	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	6.1	177	-67	170.4	62	-155.7	-1.5	113.9	D66 V68 L72 F160	D66-R70 VanDerWaalsContact O-CB 3.25Å; D66-R70 WeakPolarHBondContact O-CB 3.48Å; D66-R70 WeakPolarHBondContact O-CD 3.47Å; D66-R70 WeakPolarHBondContact O-CG 3.48Å; D66-R70 PolarHBondContact O-N 3.21Å; V68-R70 PolarHBondContact O-N 3.14Å; R70-L72 VanDerWaalsContact C-N 3.28Å; R70-L72 HydrophobicContact CB-CD1 4.09Å; R70-L72 HydrophobicContact CB-CG 3.96Å; R70-L72 PolarHBondContact O-N 2.87Å; R70-F160 PolarHBondContact NH1-O 3.28Å; R70-F160 PolarHBondContact NH2-O 3.4Å
71	R	98.3	Very high	98.3	Very high	217 Å²	217	45.8 Å²	45.8	82%	0.819	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	32.7	177.3	-50	174.1	179.1	89	-0.4	113.1	G67 V68 Q69	G67-R71 PolarHBondContact O-N 3.33Å; V68-R71 PolarHBondContact O-N 2.86Å; Q69-R71 VanDerWaalsContact C-N 3.29Å; Q69-R71 PolarHBondContact O-N 3Å
72	L	98.5	Very high	98.2	Very high	17 Å²	17	52.7 Å²	52.7	9%	0.089	25%	0.249	C	C	.	.			trans	-90	-2.2	-177	-62.2	177.5	0	0	0	114.2	G67 R70 G74 Q75 I76 F160 V168	G67-L72 WeakPolarHBondContact O-CB 3.41Å; G67-L72 PolarHBondContact O-N 3.44Å; R70-L72 VanDerWaalsContact C-N 3.28Å; R70-L72 HydrophobicContact CB-CD1 4.09Å; R70-L72 HydrophobicContact CB-CG 3.96Å; R70-L72 PolarHBondContact O-N 2.87Å; L72-G74 PolarHBondContact O-N 3.43Å; L72-Q75 PolarHBondContact O-N 2.97Å; L72-I76 HydrophobicContact CB-CD1 4.13Å; L72-I76 WeakPolarHBondContact O-CG1 3.37Å; L72-I76 PolarHBondContact O-N 3.47Å; L72-F160 HydrophobicContact CD1-CB 3.89Å; L72-F160 HydrophobicContact CD1-CG 4.21Å; L72-F160 HydrophobicContact CD2-CD1 4.14Å; L72-F160 HydrophobicContact CD2-CE1 4.38Å; L72-F160 HydrophobicContact CD2-CG 4.42Å; L72-V168 HydrophobicContact CD1-CG1 3.93Å; L72-V168 HydrophobicContact CD1-CG2 4.09Å
73	V	98.8	Very high	98	Very high	37 Å²	37	58.4 Å²	58.4	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-53.3	-52.5	-178.3	179.1	0	0	0	0	111.2	V63 V68 Q75 I76 T77 V126	V63-V73 HydrophobicContact CG1-CG2 4.25Å; V68-V73 HydrophobicContact CG2-CG2 4.04Å; V73-Q75 PolarHBondContact O-N 3.42Å; V73-I76 PolarHBondContact O-N 2.86Å; V73-T77 WeakPolarHBondContact O-CB 3.38Å; V73-T77 PolarHBondContact O-N 3.3Å; V73-T77 PolarHBondContact O-OG1 3.16Å; V73-V126 HydrophobicContact CG1-CB 4.39Å; V73-V126 HydrophobicContact CG1-CG1 4.17Å; V73-V126 HydrophobicContact CG1-CG2 4.1Å; V73-V126 HydrophobicContact CG2-CB 4.47Å; V73-V126 HydrophobicContact CG2-CG2 3.79Å
74	G	98.6	Very high	97.7	Very high	49 Å²	49	59.3 Å²	59.3	51%	0.505	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-40.4	-179.9	0	0	0	0	0	113.4	L72 I76 T77 Q78	L72-G74 PolarHBondContact O-N 3.43Å; G74-I76 VanDerWaalsContact C-N 3.35Å; G74-I76 PolarHBondContact O-N 2.97Å; G74-T77 PolarHBondContact O-N 2.81Å; G74-Q78 WeakPolarHBondContact O-CB 3.22Å; G74-Q78 PolarHBondContact O-N 2.85Å
75	Q	98.4	Very high	97.6	Very high	91 Å²	91	59.4 Å²	59.4	43%	0.425	28%	0.283	S	S	.	.	H	α-helix	trans	-64	-40	177.9	-70.1	-68.5	-34.3	0	0	112	L72 V73 R79 F160	L72-Q75 PolarHBondContact O-N 2.97Å; V73-Q75 PolarHBondContact O-N 3.42Å; Q75-R79 PolarHBondContact O-N 3.19Å; Q75-F160 HydrophobicContact CB-CE2 4.47Å; Q75-F160 HydrophobicContact CB-CZ 4.25Å
76	I	98.4	Very high	97.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.3	-51.7	177.2	-65.2	163.5	0	0	0	109.5	V63 L72 V73 G74 Q78 R79 F80 M128 V156 V168 V169	V63-I76 HydrophobicContact CB-CD1 4.33Å; V63-I76 HydrophobicContact CG1-CD1 3.76Å; V63-I76 HydrophobicContact CG2-CB 4.34Å; V63-I76 HydrophobicContact CG2-CD1 3.7Å; V63-I76 HydrophobicContact CG2-CG2 4.17Å; L72-I76 HydrophobicContact CB-CD1 4.13Å; L72-I76 WeakPolarHBondContact O-CG1 3.37Å; L72-I76 PolarHBondContact O-N 3.47Å; V73-I76 PolarHBondContact O-N 2.86Å; G74-I76 VanDerWaalsContact C-N 3.35Å; G74-I76 PolarHBondContact O-N 2.97Å; I76-Q78 VanDerWaalsContact C-N 3.29Å; I76-Q78 PolarHBondContact O-N 3.44Å; I76-R79 PolarHBondContact O-N 2.82Å; I76-R79 VanDerWaalsContact O-N 3.14Å; I76-F80 HydrophobicContact CG2-CD2 4.46Å; I76-F80 HydrophobicContact CG2-CE2 4.17Å; I76-F80 WeakPolarHBondContact O-CD2 3.29Å; I76-M128 HydrophobicContact CG2-CE 4.38Å; I76-V156 HydrophobicContact CD1-CG1 4.46Å; I76-V156 HydrophobicContact CG1-CG1 4.05Å; I76-V168 HydrophobicContact CD1-CG1 3.58Å; I76-V169 HydrophobicContact CG2-CG2 4.42Å
77	T	98.6	Very high	97.4	Very high	16 Å²	16	61.8 Å²	61.8	10%	0.098	30%	0.295	C	S	.	.	H	α-helix	trans	-54.1	-47	177.7	-60.3	0	0	0	0	111.3	V73 G74 R79 F80 E81 M128 W130	V73-T77 WeakPolarHBondContact O-CB 3.38Å; V73-T77 PolarHBondContact O-N 3.3Å; V73-T77 PolarHBondContact O-OG1 3.16Å; G74-T77 PolarHBondContact O-N 2.81Å; T77-R79 VanDerWaalsContact C-N 3.27Å; T77-R79 PolarHBondContact O-N 2.95Å; T77-F80 PolarHBondContact O-N 3.32Å; T77-E81 HydrophobicContact CG2-CG 4.17Å; T77-E81 WeakPolarHBondContact O-CG 3.41Å; T77-E81 PolarHBondContact O-N 2.87Å; T77-M128 PolarHBondContact OG1-SD 3.49Å; T77-W130 HydrophobicContact CG2-CH2 3.95Å; T77-W130 HydrophobicContact CG2-CZ2 3.98Å
78	Q	98.4	Very high	97.4	Very high	80 Å²	80	62 Å²	62	37%	0.374	30%	0.296	S	S	.	.	H	α-helix	trans	-56.2	-38.5	-179.9	-179.1	176.4	41.7	0	0	112.8	G74 I76 F80 E81 Q82	G74-Q78 WeakPolarHBondContact O-CB 3.22Å; G74-Q78 PolarHBondContact O-N 2.85Å; I76-Q78 VanDerWaalsContact C-N 3.29Å; I76-Q78 PolarHBondContact O-N 3.44Å; Q78-F80 VanDerWaalsContact C-N 3.31Å; Q78-F80 PolarHBondContact O-N 3.3Å; Q78-E81 PolarHBondContact O-N 2.66Å; Q78-Q82 HydrophobicContact CG-CG 4.11Å; Q78-Q82 VanDerWaalsContact O-CB 3.3Å; Q78-Q82 WeakPolarHBondContact O-CB 3.37Å; Q78-Q82 VanDerWaalsContact O-CG 3.26Å; Q78-Q82 WeakPolarHBondContact O-CG 3.29Å; Q78-Q82 PolarHBondContact O-N 2.83Å
79	R	98.3	Very high	97.4	Very high	56 Å²	56	61.1 Å²	61.1	21%	0.211	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-37.2	178.1	-71.7	-170.9	-173.7	-154.1	0.7	112.5	Q75 I76 T77 K83 M142 G154 T155 D159	Q75-R79 PolarHBondContact O-N 3.19Å; I76-R79 PolarHBondContact O-N 2.82Å; I76-R79 VanDerWaalsContact O-N 3.14Å; T77-R79 VanDerWaalsContact C-N 3.27Å; T77-R79 PolarHBondContact O-N 2.95Å; R79-K83 WeakPolarHBondContact O-CB 3.37Å; R79-K83 PolarHBondContact O-N 3.44Å; R79-M142 HydrophobicContact CB-CE 4.07Å; R79-M142 VanDerWaalsContact O-CE 3.24Å; R79-M142 WeakPolarHBondContact O-CE 3.34Å; R79-G154 PolarHBondContact NH1-O 3.48Å; R79-T155 VanDerWaalsContact NH1-C 3.29Å; R79-T155 PolarHBondContact NH1-O 3.41Å; R79-D159 IonicContact CZ-OD2 2.75Å; R79-D159 IonicContact NH1-OD2 3.73Å; R79-D159 PolarHBondContact NH1-OD2 3.22Å; R79-D159 IonicContact NH2-OD2 2.75Å; R79-D159 PolarHBondContact NH2-OD2 2.95Å
80	F	98.1	Very high	97.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-74.3	-40.1	177.9	-75.5	-105.3	0	0	0	111.5	V61 I76 T77 Q78 K83 G84 F85 W130 S139 M142 I143	V61-F80 HydrophobicContact CB-CZ 4.49Å; V61-F80 HydrophobicContact CG1-CE2 4.34Å; V61-F80 HydrophobicContact CG1-CZ 4.03Å; V61-F80 HydrophobicContact CG2-CE1 3.66Å; V61-F80 HydrophobicContact CG2-CZ 3.74Å; I76-F80 HydrophobicContact CG2-CD2 4.46Å; I76-F80 HydrophobicContact CG2-CE2 4.17Å; I76-F80 WeakPolarHBondContact O-CD2 3.29Å; T77-F80 PolarHBondContact O-N 3.32Å; Q78-F80 VanDerWaalsContact C-N 3.31Å; Q78-F80 PolarHBondContact O-N 3.3Å; F80-K83 WeakPolarHBondContact O-CB 3.28Å; F80-K83 PolarHBondContact O-N 2.98Å; F80-G84 PolarHBondContact O-N 3.43Å; F80-F85 AromaticContact CD1-CD2 3.87Å; F80-F85 HydrophobicContact CD1-CD2 3.87Å; F80-F85 PolarHBondContact O-N 3.39Å; F80-F85 VanDerWaalsContact O-N 3.16Å; F80-W130 HydrophobicContact CB-CD2 3.69Å; F80-W130 HydrophobicContact CB-CE3 3.78Å; F80-W130 HydrophobicContact CB-CG 4.48Å; F80-W130 HydrophobicContact CB-CH2 3.6Å; F80-W130 HydrophobicContact CB-CZ2 3.48Å; F80-W130 VanDerWaalsContact CB-CZ2 3.48Å; F80-W130 HydrophobicContact CB-CZ3 3.72Å; F80-W130 HydrophobicContact CD1-CB 4.36Å; F80-W130 AromaticContact CD1-CD1 3.73Å; F80-W130 AromaticContact CD1-CD2 3.84Å; F80-W130 HydrophobicContact CD1-CD2 3.84Å; F80-W130 AromaticContact CD1-CE2 3.94Å; F80-W130 AromaticContact CD1-CG 3.72Å; F80-W130 HydrophobicContact CD1-CG 3.72Å; F80-W130 AromaticContact CD1-NE1 3.83Å; F80-W130 HydrophobicContact CE1-CG 4.35Å; F80-W130 HydrophobicContact CG-CD2 4.04Å; F80-W130 AromaticContact CG-CE2 3.78Å; F80-W130 HydrophobicContact CG-CG 4.36Å; F80-W130 HydrophobicContact CG-CZ2 4.13Å; F80-W130 AromaticContact CG-NE1 3.92Å; F80-S139 VanDerWaalsContact CE1-OG 3.29Å; F80-S139 WeakPolarHBondContact CE1-OG 3.29Å; F80-M142 HydrophobicContact CD2-CE 4.33Å; F80-M142 HydrophobicContact CG-CE 4.39Å; F80-I143 HydrophobicContact CZ-CD1 4.18Å; F80-I143 HydrophobicContact CZ-CG1 4.37Å
81	E	96.9	Very high	97.5	Very high	110 Å²	110	56.3 Å²	56.3	51%	0.514	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-48.4	174.9	-65.5	179.4	138.8	0	0	111.5	T77 Q78 K83 G84 W130	T77-E81 HydrophobicContact CG2-CG 4.17Å; T77-E81 WeakPolarHBondContact O-CG 3.41Å; T77-E81 PolarHBondContact O-N 2.87Å; Q78-E81 PolarHBondContact O-N 2.66Å; E81-K83 PolarHBondContact O-N 3.08Å; E81-G84 WeakPolarHBondContact O-CA 3.24Å; E81-G84 PolarHBondContact O-N 2.79Å; E81-W130 HydrophobicContact CG-CH2 3.67Å; E81-W130 HydrophobicContact CG-CZ3 4.04Å
82	Q	95.4	Very high	97.5	Very high	146 Å²	146	51.6 Å²	51.6	68%	0.682	27%	0.265	S	S	*	.	H	α-helix	trans	-63.6	-25.1	178.1	-74.4	178.2	-12.4	0	0	113	Q78 G84	Q78-Q82 HydrophobicContact CG-CG 4.11Å; Q78-Q82 VanDerWaalsContact O-CB 3.3Å; Q78-Q82 WeakPolarHBondContact O-CB 3.37Å; Q78-Q82 VanDerWaalsContact O-CG 3.26Å; Q78-Q82 WeakPolarHBondContact O-CG 3.29Å; Q78-Q82 PolarHBondContact O-N 2.83Å; Q82-G84 PolarHBondContact O-N 3.36Å
83	K	94.1	Very high	97.5	Very high	122 Å²	122	52.8 Å²	52.8	53%	0.53	27%	0.271	S	S	.	.	H	α-helix	trans	-72	-19.5	173.1	-170	61.6	175.8	178.2	0	112.5	R79 F80 E81 F85 M142	R79-K83 WeakPolarHBondContact O-CB 3.37Å; R79-K83 PolarHBondContact O-N 3.44Å; F80-K83 WeakPolarHBondContact O-CB 3.28Å; F80-K83 PolarHBondContact O-N 2.98Å; E81-K83 PolarHBondContact O-N 3.08Å; K83-F85 HydrophobicContact CB-CD2 4.05Å; K83-F85 HydrophobicContact CB-CE2 4.15Å; K83-F85 HydrophobicContact CG-CD2 3.95Å; K83-F85 HydrophobicContact CG-CE2 3.56Å; K83-F85 HydrophobicContact CG-CZ 3.88Å; K83-M142 HydrophobicContact CB-CE 4.02Å; K83-M142 HydrophobicContact CB-SD 4.08Å; K83-M142 HydrophobicContact CD-SD 4.11Å; K83-M142 HydrophobicContact CG-CE 4.33Å; K83-M142 HydrophobicContact CG-SD 3.71Å
84	G	93.4	Very high	97.4	Very high	20 Å²	20	56.1 Å²	56.1	21%	0.206	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	17.4	-175.1	0	0	0	0	0	114	F80 E81 Q82	F80-G84 PolarHBondContact O-N 3.43Å; E81-G84 WeakPolarHBondContact O-CA 3.24Å; E81-G84 PolarHBondContact O-N 2.79Å; Q82-G84 PolarHBondContact O-N 3.36Å
85	F	95.8	Very high	97.3	Very high	17 Å²	17	54 Å²	54	8%	0.075	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-79.4	143	172.9	-64.7	-43.8	0	0	0	111.2	F80 K83 W130 V135 T138 M142	F80-F85 AromaticContact CD1-CD2 3.87Å; F80-F85 HydrophobicContact CD1-CD2 3.87Å; F80-F85 PolarHBondContact O-N 3.39Å; F80-F85 VanDerWaalsContact O-N 3.16Å; K83-F85 HydrophobicContact CB-CD2 4.05Å; K83-F85 HydrophobicContact CB-CE2 4.15Å; K83-F85 HydrophobicContact CG-CD2 3.95Å; K83-F85 HydrophobicContact CG-CE2 3.56Å; K83-F85 HydrophobicContact CG-CZ 3.88Å; F85-W130 HydrophobicContact CB-CB 4.45Å; F85-W130 HydrophobicContact CB-CD2 4.46Å; F85-W130 HydrophobicContact CB-CE3 3.73Å; F85-W130 HydrophobicContact CB-CZ3 4.43Å; F85-W130 WeakPolarHBondContact O-CZ3 3.47Å; F85-V135 HydrophobicContact CB-CG2 4.49Å; F85-V135 HydrophobicContact CD1-CB 4.13Å; F85-V135 HydrophobicContact CD1-CG2 3.68Å; F85-V135 HydrophobicContact CD2-CG2 3.9Å; F85-V135 HydrophobicContact CE1-CB 3.9Å; F85-V135 HydrophobicContact CE1-CG2 3.76Å; F85-V135 HydrophobicContact CE2-CG2 3.95Å; F85-V135 HydrophobicContact CG-CG2 3.77Å; F85-V135 HydrophobicContact CZ-CB 4.24Å; F85-V135 HydrophobicContact CZ-CG2 3.9Å; F85-T138 HydrophobicContact CE2-CG2 4.01Å; F85-T138 HydrophobicContact CZ-CG2 3.61Å; F85-M142 HydrophobicContact CE2-SD 3.86Å
86	K	95.8	Very high	97.2	Very high	19 Å²	19	52.8 Å²	52.8	8%	0.083	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.8	-179.9	-176	174.5	72.7	-174.4	0	110.5	R56 V88 W130 E131 D193 W194 C196	R56-K86 VanDerWaalsContact NH1-NZ 3.19Å; K86-V88 HydrophobicContact CD-CG1 4.18Å; K86-V88 VanDerWaalsContact CE-CG1 3.41Å; K86-V88 HydrophobicContact CG-CG1 3.98Å; K86-V88 PolarHBondContact O-N 2.94Å; K86-W130 CarbonylContact O-C 3.56Å; K86-W130 WeakPolarHBondContact O-CA 3.29Å; K86-E131 HydrophobicContact CB-CB 4.29Å; K86-E131 WeakPolarHBondContact CE-OE1 3.41Å; K86-E131 PolarHBondContact N-O 2.83Å; K86-E131 IonicContact NZ-OE1 3.28Å; K86-E131 PolarHBondContact NZ-OE1 2.95Å; K86-E131 PolarHBondContact O-N 2.77Å; K86-D193 IonicContact NZ-OD1 2.83Å; K86-W194 HydrophobicContact CD-CD2 4.11Å; K86-W194 HydrophobicContact CD-CG 4.41Å; K86-W194 HydrophobicContact CD-CZ2 4.14Å; K86-W194 WeakPolarHBondContact CD-O 3.23Å; K86-W194 HydrophobicContact CG-CD2 4.42Å; K86-W194 HydrophobicContact CG-CH2 4.3Å; K86-W194 HydrophobicContact CG-CZ2 3.56Å; K86-W194 PolarHBondContact NZ-O 3.15Å; K86-C196 WeakPolarHBondContact CD-SG 3.43Å; K86-C196 VanDerWaalsContact CG-SG 3.56Å
87	L	97.9	Very high	97.2	Very high	42 Å²	42	58.5 Å²	58.5	22%	0.22	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	117.2	171.1	-174.2	62.9	0	0	0	109.7	G89 L90 M128 W130 W194	L87-G89 WeakPolarHBondContact CD1-O 3.33Å; L87-L90 HydrophobicContact CD1-CB 4.38Å; L87-L90 HydrophobicContact CD2-CB 4.21Å; L87-L90 HydrophobicContact CD2-CD1 3.85Å; L87-M128 HydrophobicContact CD1-CB 4.04Å; L87-M128 HydrophobicContact CD1-CG 4.24Å; L87-W130 HydrophobicContact CB-CE3 4.08Å; L87-W130 HydrophobicContact CB-CH2 3.9Å; L87-W130 HydrophobicContact CB-CZ3 3.68Å; L87-W130 HydrophobicContact CD1-CD2 4.14Å; L87-W130 HydrophobicContact CD1-CE3 4.38Å; L87-W130 HydrophobicContact CD1-CH2 4.06Å; L87-W130 HydrophobicContact CD1-CZ2 3.81Å; L87-W130 HydrophobicContact CD1-CZ3 4.36Å; L87-W130 HydrophobicContact CD2-CH2 4.5Å; L87-W130 HydrophobicContact CG-CH2 4.37Å; L87-W194 PolarHBondContact O-NE1 3.38Å
88	V	98.2	Very high	97.1	Very high	3 Å²	3	64.6 Å²	64.6	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-11.2	-178.2	-62.7	0	0	0	0	113.6	K86 V129 E131 L191 M192	K86-V88 HydrophobicContact CD-CG1 4.18Å; K86-V88 VanDerWaalsContact CE-CG1 3.41Å; K86-V88 HydrophobicContact CG-CG1 3.98Å; K86-V88 PolarHBondContact O-N 2.94Å; V88-V129 HydrophobicContact CG2-CB 3.8Å; V88-V129 HydrophobicContact CG2-CG1 3.49Å; V88-V129 VanDerWaalsContact CG2-CG1 3.49Å; V88-V129 WeakPolarHBondContact CG2-O 3.37Å; V88-V129 PolarHBondContact N-O 3.42Å; V88-E131 HydrophobicContact CG1-CB 3.79Å; V88-E131 HydrophobicContact CG2-CB 4.31Å; V88-L191 CarbonylContact O-C 3.6Å; V88-L191 WeakPolarHBondContact O-CA 3.33Å; V88-M192 WeakPolarHBondContact CB-O 3.43Å; V88-M192 PolarHBondContact O-N 3.33Å
89	G	98.4	Very high	97	Very high	5 Å²	5	62.6 Å²	62.6	5%	0.052	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	140.8	173.7	0	0	0	0	0	110.7	L87 M128 V129	L87-G89 WeakPolarHBondContact CD1-O 3.33Å; G89-M128 CarbonylContact O-C 3.32Å; G89-M128 VanDerWaalsContact O-CA 3.27Å; G89-M128 WeakPolarHBondContact O-CA 3.29Å; G89-V129 PolarHBondContact N-O 3.1Å; G89-V129 PolarHBondContact O-N 3.09Å
90	L	98.6	Very high	97	Very high	92 Å²	92	59.9 Å²	59.9	48%	0.482	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	131.1	177.2	-178.6	145.6	0	0	0	109.5	L87 V126 V127 M128	L87-L90 HydrophobicContact CD1-CB 4.38Å; L87-L90 HydrophobicContact CD2-CB 4.21Å; L87-L90 HydrophobicContact CD2-CD1 3.85Å; L90-V126 HydrophobicContact CG-CG1 4.37Å; L90-V127 WeakPolarHBondContact CA-O 3.28Å; L90-M128 HydrophobicContact CB-CG 4.43Å; L90-M128 HydrophobicContact CD1-CG 3.92Å; L90-M128 HydrophobicContact CD1-SD 4.04Å; L90-M128 HydrophobicContact CG-CG 4.1Å
91	K	98.1	Very high	96.9	Very high	44 Å²	44	61.5 Å²	61.5	19%	0.191	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	148.8	167.4	59.5	178.8	169.4	-166.6	0	112.7	L93 V126 V127 W185 F186 E190	K91-L93 HydrophobicContact CG-CD2 4.19Å; K91-V126 WeakPolarHBondContact O-CA 3.42Å; K91-V127 PolarHBondContact N-O 3.44Å; K91-V127 PolarHBondContact O-N 2.95Å; K91-W185 WeakPolarHBondContact CE-O 3.32Å; K91-W185 PolarHBondContact NZ-O 3.2Å; K91-F186 HydrophobicContact CD-CE1 4.15Å; K91-F186 HydrophobicContact CD-CZ 4.48Å; K91-F186 HydrophobicContact CG-CE1 3.89Å; K91-F186 HydrophobicContact CG-CZ 3.9Å; K91-E190 IonicContact NZ-OE1 3.09Å; K91-E190 PolarHBondContact NZ-OE1 3.14Å; K91-E190 IonicContact NZ-OE2 3.19Å; K91-E190 PolarHBondContact NZ-OE2 3.01Å
92	M	98.5	Very high	97	Very high	118 Å²	118	60.9 Å²	60.9	58%	0.581	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.7	172	-175.7	174.1	178.5	0	0	109	V68 P124 I125 V126	V68-M92 HydrophobicContact CG1-CE 3.74Å; M92-P124 HydrophobicContact CE-CB 3.57Å; M92-P124 HydrophobicContact CE-CG 3.67Å; M92-P124 HydrophobicContact CG-CB 4.45Å; M92-I125 WeakPolarHBondContact CA-O 3.49Å; M92-V126 HydrophobicContact CB-CG2 4.1Å; M92-V126 HydrophobicContact CG-CG2 3.97Å; M92-V126 HydrophobicContact SD-CG2 4.3Å
93	L	98.4	Very high	97.1	Very high	41 Å²	41	54.7 Å²	54.7	22%	0.215	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	157.9	-179	69.5	169.7	0	0	0	112	K91 P124 I125 V127 W185	K91-L93 HydrophobicContact CG-CD2 4.19Å; L93-P124 WeakPolarHBondContact O-CA 3.25Å; L93-I125 HydrophobicContact CD2-CD1 4.45Å; L93-I125 HydrophobicContact CD2-CG1 3.97Å; L93-I125 HydrophobicContact CG-CG1 4.47Å; L93-I125 PolarHBondContact N-O 2.82Å; L93-I125 PolarHBondContact O-N 3.32Å; L93-V127 HydrophobicContact CD2-CG2 3.88Å; L93-W185 HydrophobicContact CD1-CZ3 4.28Å; L93-W185 HydrophobicContact CD2-CZ3 4.5Å
94	Q	98.1	Very high	97.2	Very high	107 Å²	107	49.6 Å²	49.6	50%	0.5	25%	0.253	S	S	.	.			trans	-81	108.6	158.6	-169	70.3	28.3	0	0	107.3	T121 G123	Q94-T121 PolarHBondContact NE2-O 2.84Å; Q94-G123 PolarHBondContact NE2-O 3.37Å; Q94-G123 PolarHBondContact OE1-O 2.57Å
95	A	96.6	Very high	97.3	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.033	27%	0.265	C	S	.	.			trans	-71.8	128.1	-174.5	0	0	0	0	0	111.3	L100 I125 W185	A95-L100 HydrophobicContact CB-CD1 3.86Å; A95-L100 HydrophobicContact CB-CD2 4.07Å; A95-L100 HydrophobicContact CB-CG 3.83Å; A95-I125 HydrophobicContact CB-CD1 3.71Å; A95-I125 HydrophobicContact CB-CG1 4.2Å; A95-W185 HydrophobicContact CB-CH2 3.7Å; A95-W185 HydrophobicContact CB-CZ3 3.95Å
96	P	96.3	Very high	97.1	Very high	67 Å²	67	58 Å²	58	44%	0.435	29%	0.287	S	S	.	.			trans	-67.3	144.1	174.9	27.2	-31.2	0	0	0	110.2	E98 Q99 L100	P96-E98 PolarHBondContact O-N 3.28Å; P96-Q99 HydrophobicContact CG-CB 3.81Å; P96-Q99 PolarHBondContact O-N 3.48Å; P96-Q99 VanDerWaalsContact O-N 3.14Å; P96-L100 PolarHBondContact O-N 2.96Å; P96-L100 VanDerWaalsContact O-N 3.14Å
97	E	96.5	Very high	97.1	Very high	119 Å²	119	59.7 Å²	59.7	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-58.8	-34.5	-177.6	-172.5	176.7	144.2	0	0	112.6	L100 S101 L117 T121	E97-L100 PolarHBondContact O-N 2.94Å; E97-S101 VanDerWaalsContact O-CB 3.32Å; E97-S101 WeakPolarHBondContact O-CB 3.42Å; E97-S101 PolarHBondContact O-N 3.37Å; E97-S101 PolarHBondContact O-OG 3.35Å; E97-L117 HydrophobicContact CG-CD1 4.34Å; E97-T121 HydrophobicContact CB-CG2 4.05Å; E97-T121 HydrophobicContact CG-CG2 4.37Å
98	E	96.8	Very high	96.9	Very high	144 Å²	144	66.6 Å²	66.6	67%	0.673	32%	0.32	S	S	*	.	H	α-helix	trans	-59.1	-48.5	176.2	-175.3	-177.1	178	0	0	111.7	P96 S101 Q102	P96-E98 PolarHBondContact O-N 3.28Å; E98-S101 WeakPolarHBondContact O-CB 3.35Å; E98-S101 PolarHBondContact O-N 2.9Å; E98-Q102 WeakPolarHBondContact O-CG 3.38Å; E98-Q102 PolarHBondContact O-N 2.95Å
99	Q	97.4	Very high	96.8	Very high	38 Å²	38	78.2 Å²	78.2	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-67.7	-38.4	-179.7	-168.2	171	8.8	0	0	111.4	P96 S101 Q102 H103 L184 W185	P96-Q99 HydrophobicContact CG-CB 3.81Å; P96-Q99 PolarHBondContact O-N 3.48Å; P96-Q99 VanDerWaalsContact O-N 3.14Å; Q99-S101 VanDerWaalsContact C-N 3.32Å; Q99-S101 PolarHBondContact O-N 2.95Å; Q99-Q102 PolarHBondContact O-N 3.3Å; Q99-H103 WeakPolarHBondContact O-CB 3.25Å; Q99-H103 PolarHBondContact O-N 3.36Å; Q99-L184 HydrophobicContact CG-CD1 4.1Å; Q99-L184 HydrophobicContact CG-CG 4.16Å; Q99-L184 PolarHBondContact NE2-O 2.94Å; Q99-W185 HydrophobicContact CG-CE3 4.4Å; Q99-W185 HydrophobicContact CG-CH2 4.39Å; Q99-W185 HydrophobicContact CG-CZ3 4.27Å
100	L	97.8	Very high	96.7	Very high	0 Å²	0	83.1 Å²	83.1	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-64.6	-36.9	172.7	-72.5	168.6	0	0	0	112.3	A95 P96 E97 Q102 H103 Y104 L117 M120 T121 W185	A95-L100 HydrophobicContact CB-CD1 3.86Å; A95-L100 HydrophobicContact CB-CD2 4.07Å; A95-L100 HydrophobicContact CB-CG 3.83Å; P96-L100 PolarHBondContact O-N 2.96Å; P96-L100 VanDerWaalsContact O-N 3.14Å; E97-L100 PolarHBondContact O-N 2.94Å; L100-Q102 VanDerWaalsContact C-N 3.35Å; L100-H103 WeakPolarHBondContact O-CB 3.21Å; L100-H103 PolarHBondContact O-N 3.14Å; L100-Y104 HydrophobicContact CD2-CE2 4.13Å; L100-Y104 WeakPolarHBondContact O-CD2 3.43Å; L100-Y104 PolarHBondContact O-N 3.45Å; L100-L117 HydrophobicContact CB-CD2 3.78Å; L100-M120 HydrophobicContact CD1-CB 3.61Å; L100-M120 HydrophobicContact CD2-CB 3.77Å; L100-M120 HydrophobicContact CD2-CE 3.91Å; L100-M120 HydrophobicContact CD2-CG 4.4Å; L100-M120 HydrophobicContact CG-CB 4.3Å; L100-T121 HydrophobicContact CD1-CG2 3.5Å; L100-W185 HydrophobicContact CD2-CH2 3.89Å; L100-W185 HydrophobicContact CD2-CZ2 4.04Å; L100-W185 HydrophobicContact CG-CH2 4.45Å
101	S	97.1	Very high	96.5	Very high	33 Å²	33	84.4 Å²	84.4	23%	0.231	40%	0.397	C	S	.	.	H	α-helix	trans	-66.6	-37.8	177.1	-65.1	0	0	0	0	112.1	E97 E98 Q99 H105 Y113 L117	E97-S101 VanDerWaalsContact O-CB 3.32Å; E97-S101 WeakPolarHBondContact O-CB 3.42Å; E97-S101 PolarHBondContact O-N 3.37Å; E97-S101 PolarHBondContact O-OG 3.35Å; E98-S101 WeakPolarHBondContact O-CB 3.35Å; E98-S101 PolarHBondContact O-N 2.9Å; Q99-S101 VanDerWaalsContact C-N 3.32Å; Q99-S101 PolarHBondContact O-N 2.95Å; S101-H105 WeakPolarHBondContact O-CA 3.34Å; S101-H105 PolarHBondContact O-N 3.48Å; S101-H105 VanDerWaalsContact O-N 3.16Å; S101-Y113 VanDerWaalsContact CA-OH 3.29Å; S101-Y113 WeakPolarHBondContact CA-OH 3.26Å; S101-Y113 WeakPolarHBondContact CB-OH 3.43Å; S101-Y113 PolarHBondContact OG-OH 3.42Å; S101-L117 WeakPolarHBondContact OG-CD1 3.49Å
102	Q	97.4	Very high	96.3	Very high	97 Å²	97	87.5 Å²	87.5	45%	0.453	41%	0.411	S	S	.	.	H	α-helix	trans	-67	-41.5	171.8	-67.4	176.2	15.3	0	0	111.3	E98 Q99 L100 Y104 H105 L184	E98-Q102 WeakPolarHBondContact O-CG 3.38Å; E98-Q102 PolarHBondContact O-N 2.95Å; Q99-Q102 PolarHBondContact O-N 3.3Å; L100-Q102 VanDerWaalsContact C-N 3.35Å; Q102-Y104 PolarHBondContact O-N 2.92Å; Q102-H105 WeakPolarHBondContact O-CB 3.48Å; Q102-H105 PolarHBondContact O-N 3.49Å; Q102-H105 PolarHBondContact O-ND1 2.81Å; Q102-L184 HydrophobicContact CB-CD1 3.95Å; Q102-L184 HydrophobicContact CB-CD2 4.06Å
103	H	97.7	Very high	96.1	Very high	17 Å²	17	82.9 Å²	82.9	8%	0.079	39%	0.387	C	S	.	.	H	α-helix	trans	-61.3	-46	178.2	-176.5	73.8	0	0	0	111.9	Q99 L100 H170 E181 L184 W185	Q99-H103 WeakPolarHBondContact O-CB 3.25Å; Q99-H103 PolarHBondContact O-N 3.36Å; L100-H103 WeakPolarHBondContact O-CB 3.21Å; L100-H103 PolarHBondContact O-N 3.14Å; H103-H170 AromaticContact CE1-CD2 3.91Å; H103-H170 AromaticContact CE1-NE2 3.48Å; H103-H170 PolarHBondContact CE1-NE2 3.1Å; H103-H170 AromaticContact NE2-CD2 3.74Å; H103-H170 AromaticContact NE2-CE1 3.71Å; H103-H170 AromaticContact NE2-NE2 3.48Å; H103-H170 PolarHBondContact NE2-NE2 2.9Å; H103-E181 IonicContact CE1-OE1 3.44Å; H103-E181 IonicContact CE1-OE2 2.86Å; H103-L184 HydrophobicContact CB-CD2 3.66Å; H103-W185 HydrophobicContact CB-CZ2 4.29Å; H103-W185 AromaticContact CE1-NE1 3.63Å; H103-W185 AromaticContact CG-NE1 3.69Å; H103-W185 AromaticContact ND1-CD1 3.98Å; H103-W185 AromaticContact ND1-NE1 3.1Å; H103-W185 PolarHBondContact ND1-NE1 3.04Å
104	Y	96.1	Very high	96	Very high	15 Å²	15	85.1 Å²	85.1	6%	0.059	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	22.4	-178.6	-64.6	-64.5	0	0	0	114.1	L100 Q102 E106 L107 R108 Y113 L116 L117 M120	L100-Y104 HydrophobicContact CD2-CE2 4.13Å; L100-Y104 WeakPolarHBondContact O-CD2 3.43Å; L100-Y104 PolarHBondContact O-N 3.45Å; Q102-Y104 PolarHBondContact O-N 2.92Å; Y104-E106 PolarHBondContact O-N 3.41Å; Y104-E106 VanDerWaalsContact O-N 3.12Å; Y104-L107 HydrophobicContact CD1-CD1 3.81Å; Y104-L107 WeakPolarHBondContact O-CA 3.09Å; Y104-L107 WeakPolarHBondContact O-CB 3.35Å; Y104-L107 PolarHBondContact O-N 2.92Å; Y104-R108 PolarHBondContact O-N 2.75Å; Y104-Y113 WeakPolarHBondContact O-CE2 3.41Å; Y104-L116 HydrophobicContact CD1-CD2 3.73Å; Y104-L116 HydrophobicContact CD2-CD2 4.04Å; Y104-L116 HydrophobicContact CD2-CG 4.25Å; Y104-L116 HydrophobicContact CE1-CD1 4.48Å; Y104-L116 HydrophobicContact CE1-CD2 3.94Å; Y104-L116 HydrophobicContact CE2-CD1 4.32Å; Y104-L116 HydrophobicContact CE2-CD2 4.26Å; Y104-L116 HydrophobicContact CE2-CG 4.2Å; Y104-L116 HydrophobicContact CG-CD2 3.75Å; Y104-L116 HydrophobicContact CG-CG 4.46Å; Y104-L117 HydrophobicContact CD2-CD2 4.48Å; Y104-M120 HydrophobicContact CE2-CE 4.43Å; Y104-M120 HydrophobicContact CE2-CG 3.84Å
105	H	95.1	Very high	95.9	Very high	96 Å²	96	84 Å²	84	44%	0.444	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-55.7	-35.6	-172.6	72.3	-81.1	0	0	0	113.7	S101 Q102 L107 R108	S101-H105 WeakPolarHBondContact O-CA 3.34Å; S101-H105 PolarHBondContact O-N 3.48Å; S101-H105 VanDerWaalsContact O-N 3.16Å; Q102-H105 WeakPolarHBondContact O-CB 3.48Å; Q102-H105 PolarHBondContact O-N 3.49Å; Q102-H105 PolarHBondContact O-ND1 2.81Å; H105-L107 PolarHBondContact O-N 3.4Å; H105-R108 VanDerWaalsContact O-CB 3.26Å; H105-R108 WeakPolarHBondContact O-CB 3.07Å; H105-R108 PolarHBondContact O-N 2.95Å
106	E	93.6	Very high	95.9	Very high	116 Å²	116	84.9 Å²	84.9	54%	0.542	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-65	-25.5	177.4	-59.5	-179.1	-164.6	0	0	112.6	Y104 R180	Y104-E106 PolarHBondContact O-N 3.41Å; Y104-E106 VanDerWaalsContact O-N 3.12Å; E106-R180 IonicContact OE1-CZ 2.85Å; E106-R180 IonicContact OE1-NH1 2.66Å; E106-R180 PolarHBondContact OE1-NH1 3.39Å; E106-R180 IonicContact OE1-NH2 3.21Å; E106-R180 PolarHBondContact OE1-NH2 3.23Å
107	L	94.4	Very high	95.9	Very high	55 Å²	55	82.3 Å²	82.3	29%	0.288	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-91.6	-2.1	-179.4	-54.3	-177.7	0	0	0	112.9	Y104 H105 R109 K110 F112 Y113 L116	Y104-L107 HydrophobicContact CD1-CD1 3.81Å; Y104-L107 WeakPolarHBondContact O-CA 3.09Å; Y104-L107 WeakPolarHBondContact O-CB 3.35Å; Y104-L107 PolarHBondContact O-N 2.92Å; H105-L107 PolarHBondContact O-N 3.4Å; L107-R109 PolarHBondContact O-N 2.73Å; L107-K110 HydrophobicContact CB-CG 4.32Å; L107-K110 HydrophobicContact CD2-CG 4.33Å; L107-K110 VanDerWaalsContact O-CB 3.25Å; L107-K110 WeakPolarHBondContact O-CB 3.27Å; L107-K110 WeakPolarHBondContact O-CG 3.36Å; L107-K110 PolarHBondContact O-N 2.75Å; L107-F112 HydrophobicContact CD1-CE2 4.3Å; L107-Y113 HydrophobicContact CB-CD2 4.1Å; L107-Y113 WeakPolarHBondContact O-CB 3.48Å; L107-L116 HydrophobicContact CD1-CD2 3.89Å
108	R	94.6	Very high	95.9	Very high	188 Å²	188	83.3 Å²	83.3	71%	0.709	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.3	-173	-171.8	175.4	179	-177.8	1.7	114.6	Y104 H105 Y113	Y104-R108 PolarHBondContact O-N 2.75Å; H105-R108 VanDerWaalsContact O-CB 3.26Å; H105-R108 WeakPolarHBondContact O-CB 3.07Å; H105-R108 PolarHBondContact O-N 2.95Å; R108-Y113 HydrophobicContact CB-CE1 4.49Å; R108-Y113 HydrophobicContact CB-CE2 4.25Å; R108-Y113 HydrophobicContact CG-CD1 4.46Å; R108-Y113 HydrophobicContact CG-CE1 4.11Å
109	R	95.7	Very high	95.9	Very high	247 Å²	247	77.2 Å²	77.2	93%	0.932	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.4	178.3	-63.9	-174.4	178.5	179.1	0.2	113.8	L107	L107-R109 PolarHBondContact O-N 2.73Å
110	K	95.7	Very high	95.9	Very high	107 Å²	107	75.5 Å²	75.5	47%	0.465	36%	0.362	S	S	.	.	S	Bend	trans	-81.4	141.8	-179.4	-59.5	-66	-175.2	177.7	0	110	L107 F112 Y113	L107-K110 HydrophobicContact CB-CG 4.32Å; L107-K110 HydrophobicContact CD2-CG 4.33Å; L107-K110 VanDerWaalsContact O-CB 3.25Å; L107-K110 WeakPolarHBondContact O-CB 3.27Å; L107-K110 WeakPolarHBondContact O-CG 3.36Å; L107-K110 PolarHBondContact O-N 2.75Å; K110-F112 HydrophobicContact CB-CD1 3.99Å; K110-F112 HydrophobicContact CB-CD2 4.32Å; K110-F112 HydrophobicContact CB-CE1 3.59Å; K110-F112 HydrophobicContact CB-CE2 3.93Å; K110-F112 HydrophobicContact CB-CG 4.35Å; K110-F112 HydrophobicContact CB-CZ 3.55Å; K110-F112 HydrophobicContact CD-CE1 4.32Å; K110-F112 HydrophobicContact CD-CZ 4.4Å; K110-F112 HydrophobicContact CG-CE1 4Å; K110-F112 HydrophobicContact CG-CE2 4.38Å; K110-F112 HydrophobicContact CG-CZ 3.73Å; K110-F112 PolarHBondContact O-N 2.85Å; K110-F112 VanDerWaalsContact O-N 3.15Å; K110-Y113 VanDerWaalsContact O-CB 3.26Å; K110-Y113 WeakPolarHBondContact O-CB 3.18Å; K110-Y113 PolarHBondContact O-N 2.83Å
111	P	95.1	Very high	95.9	Very high	120 Å²	120	77.3 Å²	77.3	78%	0.779	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-26	-176.2	24.6	-34.5	0	0	0	113.4
112	F	93	Very high	95.9	Very high	109 Å²	109	78.5 Å²	78.5	48%	0.478	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-4.4	178.8	58.6	-103.8	0	0	0	114.2	L107 K110 S115 L116	L107-F112 HydrophobicContact CD1-CE2 4.3Å; K110-F112 HydrophobicContact CB-CD1 3.99Å; K110-F112 HydrophobicContact CB-CD2 4.32Å; K110-F112 HydrophobicContact CB-CE1 3.59Å; K110-F112 HydrophobicContact CB-CE2 3.93Å; K110-F112 HydrophobicContact CB-CG 4.35Å; K110-F112 HydrophobicContact CB-CZ 3.55Å; K110-F112 HydrophobicContact CD-CE1 4.32Å; K110-F112 HydrophobicContact CD-CZ 4.4Å; K110-F112 HydrophobicContact CG-CE1 4Å; K110-F112 HydrophobicContact CG-CE2 4.38Å; K110-F112 HydrophobicContact CG-CZ 3.73Å; K110-F112 PolarHBondContact O-N 2.85Å; K110-F112 VanDerWaalsContact O-N 3.15Å; F112-S115 PolarHBondContact O-N 3.04Å; F112-L116 PolarHBondContact O-N 2.67Å
113	Y	96	Very high	96	Very high	20 Å²	20	74.1 Å²	74.1	8%	0.078	36%	0.362	C	S	.	.	H	α-helix	trans	-58.1	-44.1	-174.9	178.5	-95.7	0	0	0	114.2	S101 Y104 L107 R108 K110 S115 L116 L117	S101-Y113 VanDerWaalsContact CA-OH 3.29Å; S101-Y113 WeakPolarHBondContact CA-OH 3.26Å; S101-Y113 WeakPolarHBondContact CB-OH 3.43Å; S101-Y113 PolarHBondContact OG-OH 3.42Å; Y104-Y113 WeakPolarHBondContact O-CE2 3.41Å; L107-Y113 HydrophobicContact CB-CD2 4.1Å; L107-Y113 WeakPolarHBondContact O-CB 3.48Å; R108-Y113 HydrophobicContact CB-CE1 4.49Å; R108-Y113 HydrophobicContact CB-CE2 4.25Å; R108-Y113 HydrophobicContact CG-CD1 4.46Å; R108-Y113 HydrophobicContact CG-CE1 4.11Å; K110-Y113 VanDerWaalsContact O-CB 3.26Å; K110-Y113 WeakPolarHBondContact O-CB 3.18Å; K110-Y113 PolarHBondContact O-N 2.83Å; Y113-S115 VanDerWaalsContact C-N 3.32Å; Y113-S115 PolarHBondContact O-N 2.9Å; Y113-L116 WeakPolarHBondContact O-CB 3.38Å; Y113-L116 PolarHBondContact O-N 3.37Å; Y113-L116 VanDerWaalsContact O-N 3.16Å; Y113-L117 HydrophobicContact CD1-CD1 4.2Å; Y113-L117 HydrophobicContact CD1-CG 4.46Å; Y113-L117 HydrophobicContact CE1-CD1 3.4Å; Y113-L117 HydrophobicContact CE1-CG 3.94Å; Y113-L117 HydrophobicContact CE2-CG 4.33Å; Y113-L117 PolarHBondContact O-N 3.41Å
114	P	96.4	Very high	96	Very high	88 Å²	88	75.1 Å²	75.1	57%	0.571	37%	0.37	S	S	*	.	H	α-helix	trans	-60.3	-42	176.6	-23.7	35.2	0	0	0	112.4	L116 L117 H118	P114-L116 VanDerWaalsContact C-N 3.33Å; P114-L116 PolarHBondContact O-N 2.97Å; P114-L117 PolarHBondContact O-N 3.35Å; P114-H118 WeakPolarHBondContact O-CB 3.33Å; P114-H118 PolarHBondContact O-N 3.23Å
115	S	95.9	Very high	96.1	Very high	83 Å²	83	74.4 Å²	74.4	58%	0.58	37%	0.368	S	S	*	.	H	α-helix	trans	-67	-34.7	176.8	-53	0	0	0	0	112.3	F112 Y113 Y119	F112-S115 PolarHBondContact O-N 3.04Å; Y113-S115 VanDerWaalsContact C-N 3.32Å; Y113-S115 PolarHBondContact O-N 2.9Å; S115-Y119 VanDerWaalsContact O-CB 3.23Å; S115-Y119 WeakPolarHBondContact O-CB 3.28Å; S115-Y119 PolarHBondContact O-N 2.81Å
116	L	95.4	Very high	96.3	Very high	23 Å²	23	70 Å²	70	12%	0.12	35%	0.348	C	S	.	.	H	α-helix	trans	-64.6	-46.1	174.6	174.3	62.7	0	0	0	111.6	Y104 L107 F112 Y113 P114 Y119 M120	Y104-L116 HydrophobicContact CD1-CD2 3.73Å; Y104-L116 HydrophobicContact CD2-CD2 4.04Å; Y104-L116 HydrophobicContact CD2-CG 4.25Å; Y104-L116 HydrophobicContact CE1-CD1 4.48Å; Y104-L116 HydrophobicContact CE1-CD2 3.94Å; Y104-L116 HydrophobicContact CE2-CD1 4.32Å; Y104-L116 HydrophobicContact CE2-CD2 4.26Å; Y104-L116 HydrophobicContact CE2-CG 4.2Å; Y104-L116 HydrophobicContact CG-CD2 3.75Å; Y104-L116 HydrophobicContact CG-CG 4.46Å; L107-L116 HydrophobicContact CD1-CD2 3.89Å; F112-L116 PolarHBondContact O-N 2.67Å; Y113-L116 WeakPolarHBondContact O-CB 3.38Å; Y113-L116 PolarHBondContact O-N 3.37Å; Y113-L116 VanDerWaalsContact O-N 3.16Å; P114-L116 VanDerWaalsContact C-N 3.33Å; P114-L116 PolarHBondContact O-N 2.97Å; L116-Y119 HydrophobicContact CD1-CD1 4.37Å; L116-Y119 WeakPolarHBondContact O-CB 3.43Å; L116-Y119 PolarHBondContact O-N 2.71Å; L116-M120 HydrophobicContact CD1-CG 4.08Å; L116-M120 WeakPolarHBondContact O-CB 3.42Å; L116-M120 VanDerWaalsContact O-CG 3.31Å; L116-M120 WeakPolarHBondContact O-CG 3.17Å; L116-M120 PolarHBondContact O-N 3.46Å
117	L	96.9	Very high	96.5	Very high	13 Å²	13	64.5 Å²	64.5	7%	0.068	32%	0.322	C	S	.	.	H	α-helix	trans	-62.4	-49.7	176	-74.8	-174.2	0	0	0	111.2	E97 L100 S101 Y104 Y113 P114 Y119 M120 T121	E97-L117 HydrophobicContact CG-CD1 4.34Å; L100-L117 HydrophobicContact CB-CD2 3.78Å; S101-L117 WeakPolarHBondContact OG-CD1 3.49Å; Y104-L117 HydrophobicContact CD2-CD2 4.48Å; Y113-L117 HydrophobicContact CD1-CD1 4.2Å; Y113-L117 HydrophobicContact CD1-CG 4.46Å; Y113-L117 HydrophobicContact CE1-CD1 3.4Å; Y113-L117 HydrophobicContact CE1-CG 3.94Å; Y113-L117 HydrophobicContact CE2-CG 4.33Å; Y113-L117 PolarHBondContact O-N 3.41Å; P114-L117 PolarHBondContact O-N 3.35Å; L117-Y119 VanDerWaalsContact C-N 3.25Å; L117-Y119 PolarHBondContact O-N 3.04Å; L117-M120 PolarHBondContact O-N 3.44Å; L117-M120 VanDerWaalsContact O-N 3.08Å; L117-T121 WeakPolarHBondContact O-CG2 3.35Å; L117-T121 PolarHBondContact O-N 2.93Å; L117-T121 PolarHBondContact O-OG1 3.49Å
118	H	96.4	Very high	96.7	Very high	141 Å²	141	61.9 Å²	61.9	65%	0.653	31%	0.308	S	S	*	.	H	α-helix	trans	-57.1	-40.8	177.6	179.8	69	0	0	0	112.2	P114 T121 S122	P114-H118 WeakPolarHBondContact O-CB 3.33Å; P114-H118 PolarHBondContact O-N 3.23Å; H118-T121 PolarHBondContact O-OG1 3.26Å; H118-S122 WeakPolarHBondContact O-CB 3.38Å; H118-S122 PolarHBondContact O-N 3.37Å; H118-S122 VanDerWaalsContact O-N 3.12Å
119	Y	96.9	Very high	96.9	Very high	16 Å²	16	53 Å²	53	6%	0.063	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-53.7	173.2	163.9	-146.8	0	0	0	111.4	K64 P65 D66 S115 L116 L117 T121 S122 S165	K64-Y119 WeakPolarHBondContact CB-OH 3.12Å; K64-Y119 HydrophobicContact CD-CE1 3.81Å; P65-Y119 HydrophobicContact CB-CE2 4.31Å; P65-Y119 HydrophobicContact CG-CD2 4.47Å; P65-Y119 HydrophobicContact CG-CE2 4.31Å; D66-Y119 HydrophobicContact CB-CE2 4.43Å; D66-Y119 PolarHBondContact OD1-OH 3.29Å; D66-Y119 PolarHBondContact OD2-OH 3.31Å; S115-Y119 VanDerWaalsContact O-CB 3.23Å; S115-Y119 WeakPolarHBondContact O-CB 3.28Å; S115-Y119 PolarHBondContact O-N 2.81Å; L116-Y119 HydrophobicContact CD1-CD1 4.37Å; L116-Y119 WeakPolarHBondContact O-CB 3.43Å; L116-Y119 PolarHBondContact O-N 2.71Å; L117-Y119 VanDerWaalsContact C-N 3.25Å; L117-Y119 PolarHBondContact O-N 3.04Å; Y119-T121 PolarHBondContact O-N 2.9Å; Y119-S122 WeakPolarHBondContact O-CB 3.33Å; Y119-S122 PolarHBondContact O-N 2.9Å; Y119-S122 PolarHBondContact O-OG 3.47Å; Y119-S165 WeakPolarHBondContact CE1-O 2.94Å
120	M	97.8	Very high	97.1	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-67.9	-25	-174.6	-68.9	-68.4	-58.7	0	0	112.9	K64 L100 Y104 L116 L117 I125	K64-M120 HydrophobicContact CB-SD 4.25Å; K64-M120 HydrophobicContact CD-SD 4.03Å; K64-M120 HydrophobicContact CG-CE 4.39Å; K64-M120 HydrophobicContact CG-SD 3.86Å; L100-M120 HydrophobicContact CD1-CB 3.61Å; L100-M120 HydrophobicContact CD2-CB 3.77Å; L100-M120 HydrophobicContact CD2-CE 3.91Å; L100-M120 HydrophobicContact CD2-CG 4.4Å; L100-M120 HydrophobicContact CG-CB 4.3Å; Y104-M120 HydrophobicContact CE2-CE 4.43Å; Y104-M120 HydrophobicContact CE2-CG 3.84Å; L116-M120 HydrophobicContact CD1-CG 4.08Å; L116-M120 WeakPolarHBondContact O-CB 3.42Å; L116-M120 VanDerWaalsContact O-CG 3.31Å; L116-M120 WeakPolarHBondContact O-CG 3.17Å; L116-M120 PolarHBondContact O-N 3.46Å; L117-M120 PolarHBondContact O-N 3.44Å; L117-M120 VanDerWaalsContact O-N 3.08Å; M120-I125 HydrophobicContact CE-CD1 4.48Å; M120-I125 HydrophobicContact CE-CG2 4Å
121	T	97.4	Very high	97.2	Very high	37 Å²	37	36.5 Å²	36.5	23%	0.227	21%	0.21	C	C	.	.	H	α-helix	trans	-87.2	-5.7	173	58.2	0	0	0	0	113.8	Q94 E97 L100 L117 H118 Y119 G123	Q94-T121 PolarHBondContact NE2-O 2.84Å; E97-T121 HydrophobicContact CB-CG2 4.05Å; E97-T121 HydrophobicContact CG-CG2 4.37Å; L100-T121 HydrophobicContact CD1-CG2 3.5Å; L117-T121 WeakPolarHBondContact O-CG2 3.35Å; L117-T121 PolarHBondContact O-N 2.93Å; L117-T121 PolarHBondContact O-OG1 3.49Å; H118-T121 PolarHBondContact O-OG1 3.26Å; Y119-T121 PolarHBondContact O-N 2.9Å; T121-G123 PolarHBondContact O-N 2.92Å
122	S	97.6	Very high	97.1	Very high	58 Å²	58	30.9 Å²	30.9	41%	0.406	17%	0.173	S	C	.	.	S	Bend	trans	-72.8	-10.8	-177.4	69.2	0	0	0	0	114.8	H118 Y119	H118-S122 WeakPolarHBondContact O-CB 3.38Å; H118-S122 PolarHBondContact O-N 3.37Å; H118-S122 VanDerWaalsContact O-N 3.12Å; Y119-S122 WeakPolarHBondContact O-CB 3.33Å; Y119-S122 PolarHBondContact O-N 2.9Å; Y119-S122 PolarHBondContact O-OG 3.47Å
123	G	97.7	Very high	97.2	Very high	5 Å²	5	30.6 Å²	30.6	5%	0.052	17%	0.17	C	C	.	.	S	Bend	trans	-175.2	-178.5	-179.1	0	0	0	0	0	113.2	Q94 T121	Q94-G123 PolarHBondContact NE2-O 3.37Å; Q94-G123 PolarHBondContact OE1-O 2.57Å; T121-G123 PolarHBondContact O-N 2.92Å
124	P	98.4	Very high	97.1	Very high	39 Å²	39	32.3 Å²	32.3	25%	0.253	18%	0.181	S	C	.	.			trans	-71.4	149	-176.8	29.6	-35.7	0	0	0	111.2	P65 V68 M92 L93	P65-P124 WeakPolarHBondContact CA-O 3.5Å; V68-P124 HydrophobicContact CG1-CG 3.94Å; V68-P124 WeakPolarHBondContact CG2-O 3.46Å; M92-P124 HydrophobicContact CE-CB 3.57Å; M92-P124 HydrophobicContact CE-CG 3.67Å; M92-P124 HydrophobicContact CG-CB 4.45Å; L93-P124 WeakPolarHBondContact O-CA 3.25Å
125	I	98.6	Very high	97.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	156.5	171.5	64.6	172.6	0	0	0	109.8	V63 P65 M92 L93 A95 M120 V127 W185	V63-I125 WeakPolarHBondContact O-CA 3.26Å; V63-I125 WeakPolarHBondContact O-CB 3.3Å; P65-I125 HydrophobicContact CG-CG2 3.83Å; M92-I125 WeakPolarHBondContact CA-O 3.49Å; L93-I125 HydrophobicContact CD2-CD1 4.45Å; L93-I125 HydrophobicContact CD2-CG1 3.97Å; L93-I125 HydrophobicContact CG-CG1 4.47Å; L93-I125 PolarHBondContact N-O 2.82Å; L93-I125 PolarHBondContact O-N 3.32Å; A95-I125 HydrophobicContact CB-CD1 3.71Å; A95-I125 HydrophobicContact CB-CG1 4.2Å; M120-I125 HydrophobicContact CE-CD1 4.48Å; M120-I125 HydrophobicContact CE-CG2 4Å; I125-V127 HydrophobicContact CD1-CG2 3.58Å; I125-V127 HydrophobicContact CG1-CG2 3.92Å; I125-W185 HydrophobicContact CD1-CH2 3.53Å; I125-W185 HydrophobicContact CD1-CZ2 4.29Å; I125-W185 HydrophobicContact CD1-CZ3 3.78Å
126	V	98.8	Very high	97.3	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.024	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	114.9	168.8	179.5	0	0	0	0	107.9	A62 V63 V68 V73 L90 K91 M92 M128	A62-V126 CarbonylContact C-O 3.56Å; A62-V126 VanDerWaalsContact CA-O 3.29Å; A62-V126 WeakPolarHBondContact CA-O 3.41Å; V63-V126 HydrophobicContact CB-CB 4.2Å; V63-V126 HydrophobicContact CG2-CB 4.42Å; V63-V126 PolarHBondContact N-O 3.23Å; V63-V126 PolarHBondContact O-N 3.07Å; V63-V126 VanDerWaalsContact O-N 3.12Å; V68-V126 HydrophobicContact CG2-CG2 4.01Å; V73-V126 HydrophobicContact CG1-CB 4.39Å; V73-V126 HydrophobicContact CG1-CG1 4.17Å; V73-V126 HydrophobicContact CG1-CG2 4.1Å; V73-V126 HydrophobicContact CG2-CB 4.47Å; V73-V126 HydrophobicContact CG2-CG2 3.79Å; L90-V126 HydrophobicContact CG-CG1 4.37Å; K91-V126 WeakPolarHBondContact O-CA 3.42Å; M92-V126 HydrophobicContact CB-CG2 4.1Å; M92-V126 HydrophobicContact CG-CG2 3.97Å; M92-V126 HydrophobicContact SD-CG2 4.3Å; V126-M128 HydrophobicContact CG1-CG 4.13Å; V126-M128 HydrophobicContact CG1-SD 4.47Å
127	V	98.7	Very high	97.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.3	178.8	-164.1	0	0	0	0	108.3	L60 A62 L90 K91 L93 I125 W185 F186	L60-V127 HydrophobicContact CD1-CG1 3.67Å; L60-V127 HydrophobicContact CD2-CG1 4.06Å; L60-V127 HydrophobicContact CG-CG1 3.91Å; A62-V127 HydrophobicContact CB-CG1 4.41Å; A62-V127 HydrophobicContact CB-CG2 4.37Å; L90-V127 WeakPolarHBondContact CA-O 3.28Å; K91-V127 PolarHBondContact N-O 3.44Å; K91-V127 PolarHBondContact O-N 2.95Å; L93-V127 HydrophobicContact CD2-CG2 3.88Å; I125-V127 HydrophobicContact CD1-CG2 3.58Å; I125-V127 HydrophobicContact CG1-CG2 3.92Å; V127-W185 HydrophobicContact CG1-CB 4.13Å; V127-W185 HydrophobicContact CG1-CD2 4.25Å; V127-W185 HydrophobicContact CG1-CG 4.05Å; V127-W185 HydrophobicContact CG2-CD2 4.26Å; V127-W185 HydrophobicContact CG2-CE3 3.9Å; V127-W185 HydrophobicContact CG2-CZ3 4.13Å; V127-F186 HydrophobicContact CB-CE2 4.2Å; V127-F186 HydrophobicContact CB-CZ 4.35Å; V127-F186 HydrophobicContact CG1-CE2 3.72Å; V127-F186 HydrophobicContact CG1-CZ 4.34Å
128	M	98.8	Very high	97.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	149.9	-176.6	-64.8	176.5	-73.9	0	0	110.4	V61 V63 I76 T77 L87 G89 L90 V126 W130	V61-M128 HydrophobicContact CG1-CE 4.19Å; V61-M128 PolarHBondContact N-O 2.93Å; V61-M128 PolarHBondContact O-N 3.22Å; V63-M128 HydrophobicContact CG2-CE 3.81Å; I76-M128 HydrophobicContact CG2-CE 4.38Å; T77-M128 PolarHBondContact OG1-SD 3.49Å; L87-M128 HydrophobicContact CD1-CB 4.04Å; L87-M128 HydrophobicContact CD1-CG 4.24Å; G89-M128 CarbonylContact O-C 3.32Å; G89-M128 VanDerWaalsContact O-CA 3.27Å; G89-M128 WeakPolarHBondContact O-CA 3.29Å; L90-M128 HydrophobicContact CB-CG 4.43Å; L90-M128 HydrophobicContact CD1-CG 3.92Å; L90-M128 HydrophobicContact CD1-SD 4.04Å; L90-M128 HydrophobicContact CG-CG 4.1Å; V126-M128 HydrophobicContact CG1-CG 4.13Å; V126-M128 HydrophobicContact CG1-SD 4.47Å; M128-W130 HydrophobicContact SD-CZ2 4Å
129	V	98.8	Very high	97.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.6	169.5	-174	0	0	0	0	108.3	R58 T59 V88 G89 I182 F186 L191	R58-V129 HydrophobicContact CB-CG1 4.09Å; R58-V129 HydrophobicContact CG-CG1 4.43Å; T59-V129 WeakPolarHBondContact O-CA 3.45Å; V88-V129 HydrophobicContact CG2-CB 3.8Å; V88-V129 HydrophobicContact CG2-CG1 3.49Å; V88-V129 VanDerWaalsContact CG2-CG1 3.49Å; V88-V129 WeakPolarHBondContact CG2-O 3.37Å; V88-V129 PolarHBondContact N-O 3.42Å; G89-V129 PolarHBondContact N-O 3.1Å; G89-V129 PolarHBondContact O-N 3.09Å; V129-I182 HydrophobicContact CG1-CD1 3.77Å; V129-I182 HydrophobicContact CG1-CG1 4.05Å; V129-I182 HydrophobicContact CG2-CG1 4.13Å; V129-I182 HydrophobicContact CG2-CG2 4.33Å; V129-F186 HydrophobicContact CG2-CD2 3.53Å; V129-F186 HydrophobicContact CG2-CE2 3.45Å; V129-F186 VanDerWaalsContact CG2-CE2 3.45Å; V129-F186 HydrophobicContact CG2-CG 4.18Å; V129-F186 HydrophobicContact CG2-CZ 4.03Å; V129-L191 HydrophobicContact CB-CD2 4.18Å; V129-L191 HydrophobicContact CG1-CD2 4.45Å; V129-L191 HydrophobicContact CG2-CD2 3.88Å
130	W	98.5	Very high	97.5	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	137.3	178.9	-66.9	95.4	0	0	0	110	R58 T59 T77 F80 E81 F85 K86 L87 M128 V135	R58-W130 CarbonylContact C-O 3.59Å; R58-W130 WeakPolarHBondContact CA-O 3.4Å; T59-W130 HydrophobicContact CG2-CB 4.11Å; T59-W130 PolarHBondContact N-O 2.8Å; T59-W130 PolarHBondContact O-N 3.01Å; T59-W130 VanDerWaalsContact O-N 3.07Å; T77-W130 HydrophobicContact CG2-CH2 3.95Å; T77-W130 HydrophobicContact CG2-CZ2 3.98Å; F80-W130 HydrophobicContact CB-CD2 3.69Å; F80-W130 HydrophobicContact CB-CE3 3.78Å; F80-W130 HydrophobicContact CB-CG 4.48Å; F80-W130 HydrophobicContact CB-CH2 3.6Å; F80-W130 HydrophobicContact CB-CZ2 3.48Å; F80-W130 VanDerWaalsContact CB-CZ2 3.48Å; F80-W130 HydrophobicContact CB-CZ3 3.72Å; F80-W130 HydrophobicContact CD1-CB 4.36Å; F80-W130 AromaticContact CD1-CD1 3.73Å; F80-W130 AromaticContact CD1-CD2 3.84Å; F80-W130 HydrophobicContact CD1-CD2 3.84Å; F80-W130 AromaticContact CD1-CE2 3.94Å; F80-W130 AromaticContact CD1-CG 3.72Å; F80-W130 HydrophobicContact CD1-CG 3.72Å; F80-W130 AromaticContact CD1-NE1 3.83Å; F80-W130 HydrophobicContact CE1-CG 4.35Å; F80-W130 HydrophobicContact CG-CD2 4.04Å; F80-W130 AromaticContact CG-CE2 3.78Å; F80-W130 HydrophobicContact CG-CG 4.36Å; F80-W130 HydrophobicContact CG-CZ2 4.13Å; F80-W130 AromaticContact CG-NE1 3.92Å; E81-W130 HydrophobicContact CG-CH2 3.67Å; E81-W130 HydrophobicContact CG-CZ3 4.04Å; F85-W130 HydrophobicContact CB-CB 4.45Å; F85-W130 HydrophobicContact CB-CD2 4.46Å; F85-W130 HydrophobicContact CB-CE3 3.73Å; F85-W130 HydrophobicContact CB-CZ3 4.43Å; F85-W130 WeakPolarHBondContact O-CZ3 3.47Å; K86-W130 CarbonylContact O-C 3.56Å; K86-W130 WeakPolarHBondContact O-CA 3.29Å; L87-W130 HydrophobicContact CB-CE3 4.08Å; L87-W130 HydrophobicContact CB-CH2 3.9Å; L87-W130 HydrophobicContact CB-CZ3 3.68Å; L87-W130 HydrophobicContact CD1-CD2 4.14Å; L87-W130 HydrophobicContact CD1-CE3 4.38Å; L87-W130 HydrophobicContact CD1-CH2 4.06Å; L87-W130 HydrophobicContact CD1-CZ2 3.81Å; L87-W130 HydrophobicContact CD1-CZ3 4.36Å; L87-W130 HydrophobicContact CD2-CH2 4.5Å; L87-W130 HydrophobicContact CG-CH2 4.37Å; M128-W130 HydrophobicContact SD-CZ2 4Å; W130-V135 HydrophobicContact CB-CG2 4Å
131	E	97.6	Very high	97.5	Very high	7 Å²	7	36.4 Å²	36.4	3%	0.033	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.3	178.3	-177.4	174.8	114.1	0	0	110.6	R56 E57 R58 K86 V88	R56-E131 WeakPolarHBondContact CD-OE1 3.44Å; R56-E131 IonicContact CZ-OE1 3.35Å; R56-E131 IonicContact NE-OE1 3.77Å; R56-E131 IonicContact NH1-OE1 3.7Å; R56-E131 PolarHBondContact NH1-OE1 2.92Å; E57-E131 CarbonylContact O-C 3.53Å; E57-E131 VanDerWaalsContact O-CA 3.25Å; E57-E131 WeakPolarHBondContact O-CA 3.22Å; R58-E131 HydrophobicContact CG-CB 3.99Å; R58-E131 HydrophobicContact CG-CG 4.1Å; R58-E131 IonicContact CZ-OE2 2.95Å; R58-E131 IonicContact NE-OE2 3.95Å; R58-E131 PolarHBondContact NE-OE2 3.07Å; R58-E131 IonicContact NH2-OE2 3.88Å; R58-E131 PolarHBondContact NH2-OE2 2.94Å; K86-E131 HydrophobicContact CB-CB 4.29Å; K86-E131 WeakPolarHBondContact CE-OE1 3.41Å; K86-E131 PolarHBondContact N-O 2.83Å; K86-E131 IonicContact NZ-OE1 3.28Å; K86-E131 PolarHBondContact NZ-OE1 2.95Å; K86-E131 PolarHBondContact O-N 2.77Å; V88-E131 HydrophobicContact CG1-CB 3.79Å; V88-E131 HydrophobicContact CG2-CB 4.31Å
132	G	94.6	Very high	97.5	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.021	17%	0.171	C	C	.	.	S	Bend	trans	163.4	175	173.7	0	0	0	0	0	113.4	G54 V55 E57 N134 V135 Y203	G54-G132 CarbonylContact O-C 3.5Å; V55-G132 CarbonylContact O-C 3.57Å; V55-G132 WeakPolarHBondContact O-CA 3.42Å; E57-G132 PolarHBondContact O-N 2.86Å; G132-N134 PolarHBondContact O-N 3.24Å; G132-V135 WeakPolarHBondContact O-CB 3.39Å; G132-V135 PolarHBondContact O-N 3.4Å; G132-Y203 WeakPolarHBondContact CA-OH 3.42Å
133	Y	93.4	Very high	97.5	Very high	104 Å²	104	33.5 Å²	33.5	41%	0.408	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	124.8	-179.2	-178.1	-107.2	0	0	0	112.5	I52 P53 G54 V55 V135 Y203	I52-Y133 HydrophobicContact CG2-CD2 3.82Å; I52-Y133 HydrophobicContact CG2-CE2 3.74Å; P53-Y133 WeakPolarHBondContact O-CD2 3.39Å; P53-Y133 VanDerWaalsContact O-CE2 3.28Å; P53-Y133 WeakPolarHBondContact O-CE2 2.94Å; G54-Y133 WeakPolarHBondContact O-CA 3.41Å; V55-Y133 HydrophobicContact CG2-CD2 4.41Å; Y133-V135 PolarHBondContact O-N 3.28Å; Y133-V135 VanDerWaalsContact O-N 3.09Å; Y133-Y203 PolarHBondContact N-OH 3.46Å
134	N	95.1	Very high	97.5	Very high	56 Å²	56	33.8 Å²	33.8	30%	0.299	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	33.8	-178	-68.2	-27.3	0	0	0	112.9	E57 G132 V136 R137 T138	E57-N134 WeakPolarHBondContact OE1-CA 3.37Å; G132-N134 PolarHBondContact O-N 3.24Å; N134-V136 VanDerWaalsContact C-N 3.27Å; N134-V136 PolarHBondContact O-N 2.89Å; N134-R137 PolarHBondContact O-N 2.97Å; N134-T138 VanDerWaalsContact O-CB 3.29Å; N134-T138 WeakPolarHBondContact O-CB 3.4Å; N134-T138 PolarHBondContact O-N 3.24Å; N134-T138 PolarHBondContact O-OG1 3.36Å
135	V	97.6	Very high	97.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-35.8	-174	68.9	0	0	0	0	111.5	E57 T59 F85 W130 G132 Y133 S139	E57-V135 HydrophobicContact CB-CG1 4.21Å; E57-V135 HydrophobicContact CG-CG1 4.01Å; E57-V135 VanDerWaalsContact O-CG1 3.28Å; E57-V135 WeakPolarHBondContact O-CG1 3.38Å; E57-V135 PolarHBondContact OE1-N 3.07Å; T59-V135 HydrophobicContact CG2-CB 4.38Å; T59-V135 HydrophobicContact CG2-CG1 4Å; T59-V135 HydrophobicContact CG2-CG2 3.68Å; F85-V135 HydrophobicContact CB-CG2 4.49Å; F85-V135 HydrophobicContact CD1-CB 4.13Å; F85-V135 HydrophobicContact CD1-CG2 3.68Å; F85-V135 HydrophobicContact CD2-CG2 3.9Å; F85-V135 HydrophobicContact CE1-CB 3.9Å; F85-V135 HydrophobicContact CE1-CG2 3.76Å; F85-V135 HydrophobicContact CE2-CG2 3.95Å; F85-V135 HydrophobicContact CG-CG2 3.77Å; F85-V135 HydrophobicContact CZ-CB 4.24Å; F85-V135 HydrophobicContact CZ-CG2 3.9Å; W130-V135 HydrophobicContact CB-CG2 4Å; G132-V135 WeakPolarHBondContact O-CB 3.39Å; G132-V135 PolarHBondContact O-N 3.4Å; Y133-V135 PolarHBondContact O-N 3.28Å; Y133-V135 VanDerWaalsContact O-N 3.09Å; V135-S139 WeakPolarHBondContact O-CB 3.34Å; V135-S139 PolarHBondContact O-N 2.88Å; V135-S139 PolarHBondContact O-OG 3.21Å
136	V	98	Very high	97.1	Very high	6 Å²	6	39.9 Å²	39.9	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-55.6	178.8	174.6	0	0	0	0	110.3	E57 N134 T138 S139 R140 V175 A178	E57-V136 HydrophobicContact CG-CG2 4.05Å; E57-V136 WeakPolarHBondContact OE1-CB 3.45Å; E57-V136 WeakPolarHBondContact OE1-CG2 3.27Å; E57-V136 PolarHBondContact OE1-N 3.39Å; N134-V136 VanDerWaalsContact C-N 3.27Å; N134-V136 PolarHBondContact O-N 2.89Å; V136-T138 PolarHBondContact O-N 3.1Å; V136-S139 PolarHBondContact O-N 2.76Å; V136-R140 PolarHBondContact O-N 2.73Å; V136-V175 HydrophobicContact CG2-CG2 4.32Å; V136-A178 HydrophobicContact CG2-CB 3.95Å
137	R	97.2	Very high	96.8	Very high	184 Å²	184	41.9 Å²	41.9	69%	0.694	20%	0.199	S	C	*	.	H	α-helix	trans	-62.1	-46.3	-179.9	-179.6	179	176.1	-179.2	-0.6	111.3	N134 S139 R140 I141	N134-R137 PolarHBondContact O-N 2.97Å; R137-S139 VanDerWaalsContact C-N 3.33Å; R137-S139 PolarHBondContact O-N 3.49Å; R137-R140 PolarHBondContact O-N 2.85Å; R137-I141 HydrophobicContact CG-CD1 4.25Å; R137-I141 PolarHBondContact O-N 3.24Å
138	T	97.3	Very high	96.3	Very high	30 Å²	30	42.3 Å²	42.3	18%	0.184	20%	0.202	C	C	.	.	H	α-helix	trans	-67.1	-36.4	-176.1	-55	0	0	0	0	111.6	F85 N134 V136 R140 I141 M142	F85-T138 HydrophobicContact CE2-CG2 4.01Å; F85-T138 HydrophobicContact CZ-CG2 3.61Å; N134-T138 VanDerWaalsContact O-CB 3.29Å; N134-T138 WeakPolarHBondContact O-CB 3.4Å; N134-T138 PolarHBondContact O-N 3.24Å; N134-T138 PolarHBondContact O-OG1 3.36Å; V136-T138 PolarHBondContact O-N 3.1Å; T138-R140 VanDerWaalsContact C-N 3.33Å; T138-R140 PolarHBondContact O-N 3.29Å; T138-I141 PolarHBondContact O-N 2.71Å; T138-M142 HydrophobicContact CG2-CG 4.41Å; T138-M142 HydrophobicContact CG2-SD 4.04Å; T138-M142 WeakPolarHBondContact O-CG 3.47Å; T138-M142 PolarHBondContact O-N 2.92Å
139	S	98.1	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-41.6	175.5	-62.3	0	0	0	0	111.9	T59 F80 V135 V136 R137 I141 M142 I143	T59-S139 WeakPolarHBondContact CG2-OG 3.34Å; F80-S139 VanDerWaalsContact CE1-OG 3.29Å; F80-S139 WeakPolarHBondContact CE1-OG 3.29Å; V135-S139 WeakPolarHBondContact O-CB 3.34Å; V135-S139 PolarHBondContact O-N 2.88Å; V135-S139 PolarHBondContact O-OG 3.21Å; V136-S139 PolarHBondContact O-N 2.76Å; R137-S139 VanDerWaalsContact C-N 3.33Å; R137-S139 PolarHBondContact O-N 3.49Å; S139-I141 PolarHBondContact O-N 3.07Å; S139-M142 PolarHBondContact O-N 2.82Å; S139-I143 WeakPolarHBondContact O-CB 3.49Å; S139-I143 VanDerWaalsContact O-CG1 3.28Å; S139-I143 WeakPolarHBondContact O-CG1 3.4Å; S139-I143 PolarHBondContact O-N 3.09Å
140	R	97.8	Very high	95.7	Very high	124 Å²	124	54.3 Å²	54.3	47%	0.468	27%	0.266	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175.8	-67.7	-171.6	69.1	166.7	-3.2	112.5	V136 R137 T138 I143 G144 D173	V136-R140 PolarHBondContact O-N 2.73Å; R137-R140 PolarHBondContact O-N 2.85Å; T138-R140 VanDerWaalsContact C-N 3.33Å; T138-R140 PolarHBondContact O-N 3.29Å; R140-I143 PolarHBondContact O-N 3.01Å; R140-G144 PolarHBondContact O-N 3.3Å; R140-D173 PolarHBondContact NH1-O 3.34Å
141	I	97.7	Very high	95.6	Very high	108 Å²	108	54.8 Å²	54.8	55%	0.554	27%	0.27	S	S	*	.	H	α-helix	trans	-62.8	-46.3	177.2	-64.9	167.6	0	0	0	110.2	R137 T138 S139 I143 G144	R137-I141 HydrophobicContact CG-CD1 4.25Å; R137-I141 PolarHBondContact O-N 3.24Å; T138-I141 PolarHBondContact O-N 2.71Å; S139-I141 PolarHBondContact O-N 3.07Å; I141-I143 VanDerWaalsContact C-N 3.3Å; I141-I143 PolarHBondContact O-N 2.86Å; I141-G144 PolarHBondContact O-N 2.9Å
142	M	98.1	Very high	95.5	Very high	31 Å²	31	61.6 Å²	61.6	15%	0.153	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-34.9	178.7	-72.3	173.1	56.6	0	0	112.9	R79 F80 K83 F85 T138 S139 T155 V156	R79-M142 HydrophobicContact CB-CE 4.07Å; R79-M142 VanDerWaalsContact O-CE 3.24Å; R79-M142 WeakPolarHBondContact O-CE 3.34Å; F80-M142 HydrophobicContact CD2-CE 4.33Å; F80-M142 HydrophobicContact CG-CE 4.39Å; K83-M142 HydrophobicContact CB-CE 4.02Å; K83-M142 HydrophobicContact CB-SD 4.08Å; K83-M142 HydrophobicContact CD-SD 4.11Å; K83-M142 HydrophobicContact CG-CE 4.33Å; K83-M142 HydrophobicContact CG-SD 3.71Å; F85-M142 HydrophobicContact CE2-SD 3.86Å; T138-M142 HydrophobicContact CG2-CG 4.41Å; T138-M142 HydrophobicContact CG2-SD 4.04Å; T138-M142 WeakPolarHBondContact O-CG 3.47Å; T138-M142 PolarHBondContact O-N 2.92Å; S139-M142 PolarHBondContact O-N 2.82Å; M142-T155 CarbonylContact O-C 3.57Å; M142-T155 VanDerWaalsContact O-CA 3.29Å; M142-T155 WeakPolarHBondContact O-CA 3.38Å; M142-T155 WeakPolarHBondContact O-CB 3.39Å; M142-V156 PolarHBondContact O-N 3.36Å
143	I	97.8	Very high	95.6	Very high	2 Å²	2	66 Å²	66	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-74	-37.1	179	-76.3	168.4	0	0	0	111.6	F80 S139 R140 I141 V156 R157 V169 A171	F80-I143 HydrophobicContact CZ-CD1 4.18Å; F80-I143 HydrophobicContact CZ-CG1 4.37Å; S139-I143 WeakPolarHBondContact O-CB 3.49Å; S139-I143 VanDerWaalsContact O-CG1 3.28Å; S139-I143 WeakPolarHBondContact O-CG1 3.4Å; S139-I143 PolarHBondContact O-N 3.09Å; R140-I143 PolarHBondContact O-N 3.01Å; I141-I143 VanDerWaalsContact C-N 3.3Å; I141-I143 PolarHBondContact O-N 2.86Å; I143-V156 HydrophobicContact CG1-CG2 4.34Å; I143-V156 PolarHBondContact O-N 3.44Å; I143-R157 HydrophobicContact CG2-CG 4.16Å; I143-R157 WeakPolarHBondContact O-CB 3.18Å; I143-R157 WeakPolarHBondContact O-CG 3.29Å; I143-R157 PolarHBondContact O-N 2.82Å; I143-V169 HydrophobicContact CB-CG1 4.28Å; I143-V169 HydrophobicContact CD1-CG1 4.09Å; I143-V169 HydrophobicContact CD1-CG2 4.05Å; I143-V169 HydrophobicContact CG1-CG1 3.89Å; I143-V169 HydrophobicContact CG1-CG2 4.49Å; I143-V169 HydrophobicContact CG2-CG1 3.5Å; I143-V169 VanDerWaalsContact CG2-CG1 3.5Å; I143-A171 HydrophobicContact CD1-CB 3.26Å
144	G	97	Very high	95.7	Very high	12 Å²	12	63.6 Å²	63.6	12%	0.124	35%	0.345	C	S	.	.			trans	84.6	174.5	-177.2	0	0	0	0	0	113.5	R140 I141 R157	R140-G144 PolarHBondContact O-N 3.3Å; I141-G144 PolarHBondContact O-N 2.9Å; G144-R157 PolarHBondContact O-NH1 3.48Å
145	D	95.9	Very high	95.8	Very high	89 Å²	89	61.6 Å²	61.6	48%	0.476	34%	0.335	S	S	.	.			trans	-59.5	152.4	-172.8	-69.8	-47.4	0	0	0	113.8	N147 E150 R157	D145-N147 PolarHBondContact O-N 3.34Å; D145-E150 HydrophobicContact CB-CB 4.17Å; D145-R157 WeakPolarHBondContact O-CD 3.37Å; D145-R157 PolarHBondContact O-NH1 3.44Å
146	T	92.9	Very high	95.9	Very high	78 Å²	78	61.6 Å²	61.6	48%	0.479	34%	0.335	S	S	.	.	S	Bend	trans	-59.7	-36.5	-177.6	-61.9	0	0	0	0	112.1	P148 R157 I164 N167	T146-P148 WeakPolarHBondContact O-CD 3.47Å; T146-R157 VanDerWaalsContact CA-NH1 3.28Å; T146-I164 HydrophobicContact CG2-CD1 4.42Å; T146-I164 HydrophobicContact CG2-CG1 4.43Å; T146-N167 PolarHBondContact O-ND2 3.13Å
147	N	91.8	Very high	95.8	Very high	46 Å²	46	62.3 Å²	62.3	25%	0.246	34%	0.337	C	S	.	.	S	Bend	trans	-85.8	113.8	171.7	-175.5	2.6	0	0	0	109.6	D145 V149 E150 A151 I164	D145-N147 PolarHBondContact O-N 3.34Å; N147-V149 PolarHBondContact O-N 2.62Å; N147-V149 VanDerWaalsContact O-N 3.1Å; N147-V149 PolarHBondContact OD1-N 3.02Å; N147-E150 HydrophobicContact CB-CB 4.48Å; N147-E150 HydrophobicContact CB-CG 4.32Å; N147-E150 PolarHBondContact O-N 3.17Å; N147-A151 PolarHBondContact O-N 3.12Å; N147-I164 HydrophobicContact CB-CD1 4.38Å
148	P	88.2	Confident	95.8	Very high	9 Å²	9	54.9 Å²	54.9	6%	0.058	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.1	-179.7	-26.1	36.7	0	0	0	114.5	T146 E150 A151 S161 N167	T146-P148 WeakPolarHBondContact O-CD 3.47Å; P148-E150 PolarHBondContact O-N 3.48Å; P148-A151 PolarHBondContact O-N 2.86Å; P148-S161 WeakPolarHBondContact CB-O 3.38Å; P148-S161 VanDerWaalsContact CG-CB 3.41Å; P148-N167 HydrophobicContact CG-CB 4.18Å
149	V	90.6	Very high	95.8	Very high	120 Å²	120	56.7 Å²	56.7	73%	0.727	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-29.3	176.1	180	0	0	0	0	111.8	N147	N147-V149 PolarHBondContact O-N 2.62Å; N147-V149 VanDerWaalsContact O-N 3.1Å; N147-V149 PolarHBondContact OD1-N 3.02Å
150	E	94.4	Very high	95.8	Very high	132 Å²	132	58.5 Å²	58.5	62%	0.617	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-16.2	178.5	-61.7	178.7	155	0	0	111.8	D145 N147 P148 Q152	D145-E150 HydrophobicContact CB-CB 4.17Å; N147-E150 HydrophobicContact CB-CB 4.48Å; N147-E150 HydrophobicContact CB-CG 4.32Å; N147-E150 PolarHBondContact O-N 3.17Å; P148-E150 PolarHBondContact O-N 3.48Å; E150-Q152 PolarHBondContact O-N 3.36Å
151	A	95.8	Very high	95.6	Very high	11 Å²	11	53 Å²	53	9%	0.091	32%	0.315	C	S	.	.	S	Bend	trans	-70.4	126.3	-178.2	0	0	0	0	0	111.5	N147 P148 R157	N147-A151 PolarHBondContact O-N 3.12Å; P148-A151 PolarHBondContact O-N 2.86Å; A151-R157 HydrophobicContact CB-CB 3.85Å
152	Q	96.6	Very high	95.3	Very high	149 Å²	149	55.4 Å²	55.4	70%	0.696	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-66.9	147.7	-179	-64.1	-174.7	-31.4	0	0	112.5	E150 T155	E150-Q152 PolarHBondContact O-N 3.36Å; Q152-T155 HydrophobicContact CB-CG2 4.26Å; Q152-T155 WeakPolarHBondContact O-CB 3.35Å; Q152-T155 WeakPolarHBondContact O-CG2 3.42Å; Q152-T155 PolarHBondContact O-N 3.31Å; Q152-T155 VanDerWaalsContact O-N 3.08Å; Q152-T155 PolarHBondContact O-OG1 3.42Å
153	A	96.3	Very high	95	Very high	95 Å²	95	59.3 Å²	59.3	79%	0.785	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	139.1	169.9	0	0	0	0	0	110.6	T155	A153-T155 VanDerWaalsContact C-N 3.33Å
154	G	95.8	Very high	94.7	Very high	53 Å²	53	63.3 Å²	63.3	55%	0.546	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-10.3	-171.9	0	0	0	0	0	114.2	R79 D159	R79-G154 PolarHBondContact NH1-O 3.48Å; G154-D159 VanDerWaalsContact CA-OD2 3.22Å; G154-D159 WeakPolarHBondContact CA-OD2 3.41Å; G154-D159 PolarHBondContact N-OD1 2.65Å; G154-D159 PolarHBondContact N-OD2 3.35Å
155	T	98.1	Very high	94.3	Very high	14 Å²	14	65.7 Å²	65.7	9%	0.086	38%	0.38	C	S	.	.	S	Bend	trans	-85.9	157	167.6	69.8	0	0	0	0	111	R79 M142 Q152 A153 R157 G158 D159	R79-T155 VanDerWaalsContact NH1-C 3.29Å; R79-T155 PolarHBondContact NH1-O 3.41Å; M142-T155 CarbonylContact O-C 3.57Å; M142-T155 VanDerWaalsContact O-CA 3.29Å; M142-T155 WeakPolarHBondContact O-CA 3.38Å; M142-T155 WeakPolarHBondContact O-CB 3.39Å; Q152-T155 HydrophobicContact CB-CG2 4.26Å; Q152-T155 WeakPolarHBondContact O-CB 3.35Å; Q152-T155 WeakPolarHBondContact O-CG2 3.42Å; Q152-T155 PolarHBondContact O-N 3.31Å; Q152-T155 VanDerWaalsContact O-N 3.08Å; Q152-T155 PolarHBondContact O-OG1 3.42Å; A153-T155 VanDerWaalsContact C-N 3.33Å; T155-R157 VanDerWaalsContact C-N 3.27Å; T155-R157 PolarHBondContact O-N 3.06Å; T155-G158 PolarHBondContact O-N 2.91Å; T155-G158 PolarHBondContact OG1-N 3.35Å; T155-D159 WeakPolarHBondContact O-CB 3.35Å; T155-D159 PolarHBondContact O-N 2.77Å
156	V	97.8	Very high	94.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-57.2	-42.9	179.5	178	0	0	0	0	111.2	I76 M142 I143 F160 V168 V169	I76-V156 HydrophobicContact CD1-CG1 4.46Å; I76-V156 HydrophobicContact CG1-CG1 4.05Å; M142-V156 PolarHBondContact O-N 3.36Å; I143-V156 HydrophobicContact CG1-CG2 4.34Å; I143-V156 PolarHBondContact O-N 3.44Å; V156-F160 HydrophobicContact CG1-CD2 4.03Å; V156-F160 WeakPolarHBondContact O-CB 3.16Å; V156-F160 VanDerWaalsContact O-CD2 3.29Å; V156-F160 WeakPolarHBondContact O-CD2 3.37Å; V156-F160 PolarHBondContact O-N 2.8Å; V156-V168 HydrophobicContact CG1-CG1 4.45Å; V156-V169 HydrophobicContact CB-CG1 4.34Å; V156-V169 HydrophobicContact CG1-CB 4.46Å; V156-V169 HydrophobicContact CG1-CG1 3.79Å
157	R	97.9	Very high	94.2	Very high	22 Å²	22	63.7 Å²	63.7	8%	0.083	36%	0.358	C	S	.	.	H	α-helix	trans	-76.1	-38.1	-179.2	-71.2	174.9	-178.8	155.8	-3.8	112.4	I143 G144 D145 T146 A151 T155 D159 S161 N167 V169	I143-R157 HydrophobicContact CG2-CG 4.16Å; I143-R157 WeakPolarHBondContact O-CB 3.18Å; I143-R157 WeakPolarHBondContact O-CG 3.29Å; I143-R157 PolarHBondContact O-N 2.82Å; G144-R157 PolarHBondContact O-NH1 3.48Å; D145-R157 WeakPolarHBondContact O-CD 3.37Å; D145-R157 PolarHBondContact O-NH1 3.44Å; T146-R157 VanDerWaalsContact CA-NH1 3.28Å; A151-R157 HydrophobicContact CB-CB 3.85Å; T155-R157 VanDerWaalsContact C-N 3.27Å; T155-R157 PolarHBondContact O-N 3.06Å; R157-D159 VanDerWaalsContact C-N 3.29Å; R157-D159 PolarHBondContact O-N 2.86Å; R157-S161 WeakPolarHBondContact O-CA 3.46Å; R157-S161 VanDerWaalsContact O-CB 3.26Å; R157-S161 WeakPolarHBondContact O-CB 3.36Å; R157-S161 PolarHBondContact O-N 3.32Å; R157-N167 HydrophobicContact CG-CB 4.43Å; R157-N167 PolarHBondContact NE-O 3.01Å; R157-V169 PolarHBondContact NH2-O 3.28Å
158	G	97	Very high	94.4	Very high	28 Å²	28	61.5 Å²	61.5	29%	0.289	35%	0.346	S	S	.	.	H	α-helix	trans	-62	-38	175	0	0	0	0	0	112.5	T155	T155-G158 PolarHBondContact O-N 2.91Å; T155-G158 PolarHBondContact OG1-N 3.35Å
159	D	97.3	Very high	94.8	Very high	67 Å²	67	61.1 Å²	61.1	36%	0.358	34%	0.343	S	S	.	.	H	α-helix	trans	-86.2	-29.5	-176.5	-61.2	-24.2	0	0	0	113.3	R79 G154 T155 R157	R79-D159 IonicContact CZ-OD2 2.75Å; R79-D159 IonicContact NH1-OD2 3.73Å; R79-D159 PolarHBondContact NH1-OD2 3.22Å; R79-D159 IonicContact NH2-OD2 2.75Å; R79-D159 PolarHBondContact NH2-OD2 2.95Å; G154-D159 VanDerWaalsContact CA-OD2 3.22Å; G154-D159 WeakPolarHBondContact CA-OD2 3.41Å; G154-D159 PolarHBondContact N-OD1 2.65Å; G154-D159 PolarHBondContact N-OD2 3.35Å; T155-D159 WeakPolarHBondContact O-CB 3.35Å; T155-D159 PolarHBondContact O-N 2.77Å; R157-D159 VanDerWaalsContact C-N 3.29Å; R157-D159 PolarHBondContact O-N 2.86Å
160	F	96.7	Very high	95.1	Very high	38 Å²	38	56.6 Å²	56.6	17%	0.167	31%	0.314	C	S	.	.	H	α-helix	trans	-123	-4.1	-169.3	-53.8	-55.8	0	0	0	115.5	R70 L72 Q75 V156 V168	R70-F160 PolarHBondContact NH1-O 3.28Å; R70-F160 PolarHBondContact NH2-O 3.4Å; L72-F160 HydrophobicContact CD1-CB 3.89Å; L72-F160 HydrophobicContact CD1-CG 4.21Å; L72-F160 HydrophobicContact CD2-CD1 4.14Å; L72-F160 HydrophobicContact CD2-CE1 4.38Å; L72-F160 HydrophobicContact CD2-CG 4.42Å; Q75-F160 HydrophobicContact CB-CE2 4.47Å; Q75-F160 HydrophobicContact CB-CZ 4.25Å; V156-F160 HydrophobicContact CG1-CD2 4.03Å; V156-F160 WeakPolarHBondContact O-CB 3.16Å; V156-F160 VanDerWaalsContact O-CD2 3.29Å; V156-F160 WeakPolarHBondContact O-CD2 3.37Å; V156-F160 PolarHBondContact O-N 2.8Å; F160-V168 HydrophobicContact CB-CG2 4.44Å
161	S	94.4	Very high	95.3	Very high	10 Å²	10	51 Å²	51	7%	0.07	29%	0.29	C	S	.	.			trans	-121.7	145.9	-177.7	-53.6	0	0	0	0	111.4	P148 R157 N167 V168	P148-S161 WeakPolarHBondContact CB-O 3.38Å; P148-S161 VanDerWaalsContact CG-CB 3.41Å; R157-S161 WeakPolarHBondContact O-CA 3.46Å; R157-S161 VanDerWaalsContact O-CB 3.26Å; R157-S161 WeakPolarHBondContact O-CB 3.36Å; R157-S161 PolarHBondContact O-N 3.32Å; S161-N167 WeakPolarHBondContact OG-CA 3.32Å; S161-V168 WeakPolarHBondContact OG-CG2 3.49Å
162	I	91.2	Very high	95.4	Very high	157 Å²	157	50.5 Å²	50.5	81%	0.805	29%	0.286	S	S	*	.	S	Bend	trans	-115.5	-38.7	179.2	-60.5	173.1	0	0	0	110.7
163	H	91.7	Very high	95.4	Very high	113 Å²	113	47.4 Å²	47.4	52%	0.523	27%	0.274	S	S	.	.	S	Bend	trans	-127.6	143.9	-173.7	-170.4	-95.1	0	0	0	111.3	S165 R166	H163-S165 PolarHBondContact ND1-N 3.19Å; H163-S165 PolarHBondContact ND1-OG 3.48Å; H163-S165 PolarHBondContact O-N 3.12Å; H163-S165 VanDerWaalsContact O-N 3.12Å; H163-R166 CarbonylContact O-C 3.59Å; H163-R166 PolarHBondContact O-N 3.48Å
164	I	90.8	Very high	95.4	Very high	86 Å²	86	44.6 Å²	44.6	44%	0.441	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-57.3	-30.4	-175.4	-168.9	167.6	0	0	0	113.9	T146 N147 R166	T146-I164 HydrophobicContact CG2-CD1 4.42Å; T146-I164 HydrophobicContact CG2-CG1 4.43Å; N147-I164 HydrophobicContact CB-CD1 4.38Å; I164-R166 PolarHBondContact O-N 3.09Å
165	S	89.5	Confident	95.5	Very high	63 Å²	63	44.4 Å²	44.4	44%	0.441	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-71.2	-16.8	177.7	65.7	0	0	0	0	114.1	Y119 H163	Y119-S165 WeakPolarHBondContact CE1-O 2.94Å; H163-S165 PolarHBondContact ND1-N 3.19Å; H163-S165 PolarHBondContact ND1-OG 3.48Å; H163-S165 PolarHBondContact O-N 3.12Å; H163-S165 VanDerWaalsContact O-N 3.12Å
166	R	92.4	Very high	95.5	Very high	119 Å²	119	49.7 Å²	49.7	45%	0.449	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-134.4	65.3	-177.2	-59.9	-62.5	-169.7	-155.4	2.7	109.7	D66 H163 I164	D66-R166 WeakPolarHBondContact OD2-CA 3.47Å; H163-R166 CarbonylContact O-C 3.59Å; H163-R166 PolarHBondContact O-N 3.48Å; I164-R166 PolarHBondContact O-N 3.09Å
167	N	94.2	Very high	95.5	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.032	26%	0.261	C	S	.	.			trans	-99	23	-174.9	72.2	-9.8	0	0	0	114.4	K64 T146 P148 R157 S161 V169	K64-N167 PolarHBondContact NZ-OD1 3.04Å; T146-N167 PolarHBondContact O-ND2 3.13Å; P148-N167 HydrophobicContact CG-CB 4.18Å; R157-N167 HydrophobicContact CG-CB 4.43Å; R157-N167 PolarHBondContact NE-O 3.01Å; S161-N167 WeakPolarHBondContact OG-CA 3.32Å; N167-V169 PolarHBondContact O-N 2.61Å
168	V	95.2	Very high	95.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.			trans	65.3	-40.1	164.5	175.6	0	0	0	0	117.6	K64 D66 L72 I76 V156 F160 S161	K64-V168 WeakPolarHBondContact CB-O 3.44Å; K64-V168 PolarHBondContact N-O 3.29Å; D66-V168 WeakPolarHBondContact OD1-CA 3.43Å; D66-V168 WeakPolarHBondContact OD2-CA 3.34Å; D66-V168 PolarHBondContact OD2-N 3.02Å; D66-V168 VanDerWaalsContact OD2-N 3.07Å; L72-V168 HydrophobicContact CD1-CG1 3.93Å; L72-V168 HydrophobicContact CD1-CG2 4.09Å; I76-V168 HydrophobicContact CD1-CG1 3.58Å; V156-V168 HydrophobicContact CG1-CG1 4.45Å; F160-V168 HydrophobicContact CB-CG2 4.44Å; S161-V168 WeakPolarHBondContact OG-CG2 3.49Å
169	V	97.4	Very high	95.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	145.1	-167.2	69.5	0	0	0	0	112.3	V61 A62 I76 I143 V156 R157 N167	V61-V169 HydrophobicContact CG1-CG2 3.69Å; A62-V169 CarbonylContact O-C 3.55Å; A62-V169 WeakPolarHBondContact O-CA 3.33Å; I76-V169 HydrophobicContact CG2-CG2 4.42Å; I143-V169 HydrophobicContact CB-CG1 4.28Å; I143-V169 HydrophobicContact CD1-CG1 4.09Å; I143-V169 HydrophobicContact CD1-CG2 4.05Å; I143-V169 HydrophobicContact CG1-CG1 3.89Å; I143-V169 HydrophobicContact CG1-CG2 4.49Å; I143-V169 HydrophobicContact CG2-CG1 3.5Å; I143-V169 VanDerWaalsContact CG2-CG1 3.5Å; V156-V169 HydrophobicContact CB-CG1 4.34Å; V156-V169 HydrophobicContact CG1-CB 4.46Å; V156-V169 HydrophobicContact CG1-CG1 3.79Å; R157-V169 PolarHBondContact NH2-O 3.28Å; N167-V169 PolarHBondContact O-N 2.61Å
170	H	97.7	Very high	95.5	Very high	26 Å²	26	54.5 Å²	54.5	12%	0.12	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	147.2	167.4	171.1	76.7	0	0	0	109.8	V61 A62 H103 E181	V61-H170 CarbonylContact C-O 3.58Å; V61-H170 WeakPolarHBondContact CA-O 3.31Å; A62-H170 HydrophobicContact CB-CB 4.26Å; A62-H170 PolarHBondContact N-O 2.94Å; A62-H170 PolarHBondContact O-N 3.08Å; H103-H170 AromaticContact CE1-CD2 3.91Å; H103-H170 AromaticContact CE1-NE2 3.48Å; H103-H170 PolarHBondContact CE1-NE2 3.1Å; H103-H170 AromaticContact NE2-CD2 3.74Å; H103-H170 AromaticContact NE2-CE1 3.71Å; H103-H170 AromaticContact NE2-NE2 3.48Å; H103-H170 PolarHBondContact NE2-NE2 2.9Å; H170-E181 IonicContact CD2-OE2 3.82Å; H170-E181 IonicContact CE1-OE1 2.76Å; H170-E181 IonicContact NE2-OE1 3.45Å; H170-E181 PolarHBondContact NE2-OE1 3Å; H170-E181 IonicContact NE2-OE2 3.87Å; H170-E181 PolarHBondContact NE2-OE2 3.29Å; H170-E181 VanDerWaalsContact NE2-OE2 3.09Å
171	A	97.6	Very high	95.6	Very high	14 Å²	14	53.5 Å²	53.5	12%	0.116	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.5	163.6	0	0	0	0	0	110.5	L60 V61 I143	L60-A171 VanDerWaalsContact O-CA 3.29Å; L60-A171 WeakPolarHBondContact O-CA 3.49Å; V61-A171 HydrophobicContact CG2-CB 4.23Å; I143-A171 HydrophobicContact CD1-CB 3.26Å
172	S	98	Very high	95.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.266	C	S	.	.			trans	-56.4	142.9	177.3	-44.8	0	0	0	0	111.7	L60 A178 E181	L60-S172 WeakPolarHBondContact CB-OG 3.45Å; L60-S172 PolarHBondContact N-OG 3.08Å; L60-S172 VanDerWaalsContact N-OG 3.13Å; L60-S172 PolarHBondContact O-N 3.14Å; L60-S172 VanDerWaalsContact O-N 3.09Å; L60-S172 PolarHBondContact O-OG 2.9Å; S172-A178 WeakPolarHBondContact OG-CA 3.25Å; S172-E181 WeakPolarHBondContact CA-OE2 3.26Å; S172-E181 WeakPolarHBondContact CB-OE2 3.39Å; S172-E181 PolarHBondContact OG-OE2 3.4Å
173	D	96.2	Very high	96.1	Very high	84 Å²	84	53.5 Å²	53.5	45%	0.449	26%	0.262	S	S	.	.	S	Bend	trans	-90.4	-21	-171.8	69.8	-11.2	0	0	0	114.4	R140	R140-D173 PolarHBondContact NH1-O 3.34Å
174	S	97.3	Very high	96.4	Very high	37 Å²	37	50.2 Å²	50.2	26%	0.259	25%	0.248	S	C	.	.	S	Bend	trans	-152.1	163.4	-171.2	56.5	0	0	0	0	110.3	E176 G177 A178	S174-E176 VanDerWaalsContact C-N 3.34Å; S174-G177 PolarHBondContact O-N 3.27Å; S174-G177 WeakPolarHBondContact OG-CA 3.44Å; S174-G177 PolarHBondContact OG-N 2.78Å; S174-A178 WeakPolarHBondContact O-CB 3.23Å; S174-A178 PolarHBondContact O-N 2.97Å
175	V	97.3	Very high	96.8	Very high	48 Å²	48	46.3 Å²	46.3	29%	0.291	23%	0.228	S	C	.	.	H	α-helix	trans	-66.7	-40.9	179	177.5	0	0	0	0	110.4	E57 V136 A178 Q179	E57-V175 WeakPolarHBondContact OE2-CG2 3.22Å; V136-V175 HydrophobicContact CG2-CG2 4.32Å; V175-A178 WeakPolarHBondContact O-CB 3.47Å; V175-A178 PolarHBondContact O-N 2.86Å; V175-Q179 WeakPolarHBondContact O-CG 3.46Å; V175-Q179 PolarHBondContact O-N 2.96Å
176	E	97.3	Very high	97.2	Very high	125 Å²	125	43.8 Å²	43.8	58%	0.584	21%	0.209	S	C	*	.	H	α-helix	trans	-65.5	-44.3	176.6	-61.9	69.9	-153.3	0	0	110.6	S174 A178 Q179 R180	S174-E176 VanDerWaalsContact C-N 3.34Å; E176-A178 VanDerWaalsContact C-N 3.34Å; E176-A178 PolarHBondContact O-N 2.91Å; E176-Q179 PolarHBondContact O-N 2.76Å; E176-R180 WeakPolarHBondContact O-CG 3.46Å; E176-R180 PolarHBondContact O-N 3.29Å; E176-R180 VanDerWaalsContact O-N 3.14Å
177	G	97.6	Very high	97.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.8	-46.4	173.3	0	0	0	0	0	111.8	S174 Q179 R180 E181	S174-G177 PolarHBondContact O-N 3.27Å; S174-G177 WeakPolarHBondContact OG-CA 3.44Å; S174-G177 PolarHBondContact OG-N 2.78Å; G177-Q179 PolarHBondContact O-N 3.44Å; G177-R180 PolarHBondContact O-N 3.17Å; G177-E181 WeakPolarHBondContact O-CB 3.33Å; G177-E181 VanDerWaalsContact O-CG 3.26Å; G177-E181 WeakPolarHBondContact O-CG 3.5Å; G177-E181 PolarHBondContact O-N 3.12Å
178	A	98.2	Very high	97.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.4	-45	176.6	0	0	0	0	0	112.7	R58 V136 S172 S174 V175 E176 R180 E181 I182	R58-A178 WeakPolarHBondContact O-CB 3.42Å; V136-A178 HydrophobicContact CG2-CB 3.95Å; S172-A178 WeakPolarHBondContact OG-CA 3.25Å; S174-A178 WeakPolarHBondContact O-CB 3.23Å; S174-A178 PolarHBondContact O-N 2.97Å; V175-A178 WeakPolarHBondContact O-CB 3.47Å; V175-A178 PolarHBondContact O-N 2.86Å; E176-A178 VanDerWaalsContact C-N 3.34Å; E176-A178 PolarHBondContact O-N 2.91Å; A178-R180 PolarHBondContact O-N 3.16Å; A178-E181 PolarHBondContact O-N 3.49Å; A178-I182 WeakPolarHBondContact O-CB 3.44Å; A178-I182 WeakPolarHBondContact O-CD1 3.49Å; A178-I182 WeakPolarHBondContact O-CG1 3.44Å; A178-I182 PolarHBondContact O-N 2.9Å
179	Q	97.6	Very high	97.6	Very high	112 Å²	112	63.5 Å²	63.5	52%	0.523	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-46.5	178.1	-71.7	174.3	1.1	0	0	112	V175 E176 G177 Q183	V175-Q179 WeakPolarHBondContact O-CG 3.46Å; V175-Q179 PolarHBondContact O-N 2.96Å; E176-Q179 PolarHBondContact O-N 2.76Å; G177-Q179 PolarHBondContact O-N 3.44Å; Q179-Q183 VanDerWaalsContact O-CG 3.25Å; Q179-Q183 WeakPolarHBondContact O-CG 3.47Å; Q179-Q183 PolarHBondContact O-N 2.9Å; Q179-Q183 VanDerWaalsContact O-N 3.08Å
180	R	97.9	Very high	97.6	Very high	106 Å²	106	66.4 Å²	66.4	40%	0.4	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-46.2	177	-64.1	-172.2	-21.7	-113.9	4.9	111.8	E106 E176 G177 A178 Q183 L184	E106-R180 IonicContact OE1-CZ 2.85Å; E106-R180 IonicContact OE1-NH1 2.66Å; E106-R180 PolarHBondContact OE1-NH1 3.39Å; E106-R180 IonicContact OE1-NH2 3.21Å; E106-R180 PolarHBondContact OE1-NH2 3.23Å; E176-R180 WeakPolarHBondContact O-CG 3.46Å; E176-R180 PolarHBondContact O-N 3.29Å; E176-R180 VanDerWaalsContact O-N 3.14Å; G177-R180 PolarHBondContact O-N 3.17Å; A178-R180 PolarHBondContact O-N 3.16Å; R180-Q183 PolarHBondContact O-N 2.92Å; R180-L184 WeakPolarHBondContact O-CB 3.44Å; R180-L184 PolarHBondContact O-N 2.96Å
181	E	98.3	Very high	97.6	Very high	17 Å²	17	66.7 Å²	66.7	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-46.1	-179.7	-73.5	179.1	-178.4	0	0	111.2	L60 H103 H170 S172 G177 A178 Q183 L184 W185	L60-E181 HydrophobicContact CB-CB 3.99Å; L60-E181 HydrophobicContact CD1-CB 4.28Å; L60-E181 HydrophobicContact CD2-CB 4.15Å; L60-E181 HydrophobicContact CG-CB 4.36Å; H103-E181 IonicContact CE1-OE1 3.44Å; H103-E181 IonicContact CE1-OE2 2.86Å; H170-E181 IonicContact CD2-OE2 3.82Å; H170-E181 IonicContact CE1-OE1 2.76Å; H170-E181 IonicContact NE2-OE1 3.45Å; H170-E181 PolarHBondContact NE2-OE1 3Å; H170-E181 IonicContact NE2-OE2 3.87Å; H170-E181 PolarHBondContact NE2-OE2 3.29Å; H170-E181 VanDerWaalsContact NE2-OE2 3.09Å; S172-E181 WeakPolarHBondContact CA-OE2 3.26Å; S172-E181 WeakPolarHBondContact CB-OE2 3.39Å; S172-E181 PolarHBondContact OG-OE2 3.4Å; G177-E181 WeakPolarHBondContact O-CB 3.33Å; G177-E181 VanDerWaalsContact O-CG 3.26Å; G177-E181 WeakPolarHBondContact O-CG 3.5Å; G177-E181 PolarHBondContact O-N 3.12Å; A178-E181 PolarHBondContact O-N 3.49Å; E181-Q183 VanDerWaalsContact C-N 3.33Å; E181-Q183 PolarHBondContact O-N 3.27Å; E181-L184 WeakPolarHBondContact O-CB 3.43Å; E181-L184 PolarHBondContact O-N 3.5Å; E181-L184 VanDerWaalsContact O-N 3.17Å; E181-W185 PolarHBondContact O-N 3.42Å
182	I	98.5	Very high	97.5	Very high	16 Å²	16	70.8 Å²	70.8	8%	0.082	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-43.6	178	-68.4	164.1	0	0	0	110.6	R58 L60 V129 A178 L184 W185 F186 L191	R58-I182 HydrophobicContact CB-CD1 3.64Å; L60-I182 HydrophobicContact CB-CG1 4.1Å; L60-I182 HydrophobicContact CD1-CG1 4.27Å; V129-I182 HydrophobicContact CG1-CD1 3.77Å; V129-I182 HydrophobicContact CG1-CG1 4.05Å; V129-I182 HydrophobicContact CG2-CG1 4.13Å; V129-I182 HydrophobicContact CG2-CG2 4.33Å; A178-I182 WeakPolarHBondContact O-CB 3.44Å; A178-I182 WeakPolarHBondContact O-CD1 3.49Å; A178-I182 WeakPolarHBondContact O-CG1 3.44Å; A178-I182 PolarHBondContact O-N 2.9Å; I182-L184 VanDerWaalsContact C-N 3.3Å; I182-L184 PolarHBondContact O-N 3.02Å; I182-W185 PolarHBondContact O-N 2.98Å; I182-F186 PolarHBondContact O-N 3.4Å; I182-L191 HydrophobicContact CG2-CD1 3.91Å
183	Q	98	Very high	97.3	Very high	152 Å²	152	76.3 Å²	76.3	71%	0.71	36%	0.356	S	S	*	.	H	α-helix	trans	-64.2	-34.6	177.2	-71.9	172.4	17	0	0	112.8	Q179 R180 E181	Q179-Q183 VanDerWaalsContact O-CG 3.25Å; Q179-Q183 WeakPolarHBondContact O-CG 3.47Å; Q179-Q183 PolarHBondContact O-N 2.9Å; Q179-Q183 VanDerWaalsContact O-N 3.08Å; R180-Q183 PolarHBondContact O-N 2.92Å; E181-Q183 VanDerWaalsContact C-N 3.33Å; E181-Q183 PolarHBondContact O-N 3.27Å
184	L	98.1	Very high	97.1	Very high	43 Å²	43	77.9 Å²	77.9	23%	0.225	36%	0.356	C	S	.	.	H	α-helix	trans	-69.8	-39.6	176.3	177.5	63.5	0	0	0	112	Q99 Q102 H103 R180 E181 I182	Q99-L184 HydrophobicContact CG-CD1 4.1Å; Q99-L184 HydrophobicContact CG-CG 4.16Å; Q99-L184 PolarHBondContact NE2-O 2.94Å; Q102-L184 HydrophobicContact CB-CD1 3.95Å; Q102-L184 HydrophobicContact CB-CD2 4.06Å; H103-L184 HydrophobicContact CB-CD2 3.66Å; R180-L184 WeakPolarHBondContact O-CB 3.44Å; R180-L184 PolarHBondContact O-N 2.96Å; E181-L184 WeakPolarHBondContact O-CB 3.43Å; E181-L184 PolarHBondContact O-N 3.5Å; E181-L184 VanDerWaalsContact O-N 3.17Å; I182-L184 VanDerWaalsContact C-N 3.3Å; I182-L184 PolarHBondContact O-N 3.02Å
185	W	98.3	Very high	96.6	Very high	5 Å²	5	82.7 Å²	82.7	2%	0.019	38%	0.379	C	S	.	.	H	α-helix	trans	-92.8	-28.3	-173.1	-73.2	104.6	0	0	0	113.9	L60 K91 L93 A95 Q99 L100 H103 I125 V127 E181 I182	L60-W185 HydrophobicContact CD1-CB 3.75Å; L60-W185 HydrophobicContact CD1-CG 3.88Å; K91-W185 WeakPolarHBondContact CE-O 3.32Å; K91-W185 PolarHBondContact NZ-O 3.2Å; L93-W185 HydrophobicContact CD1-CZ3 4.28Å; L93-W185 HydrophobicContact CD2-CZ3 4.5Å; A95-W185 HydrophobicContact CB-CH2 3.7Å; A95-W185 HydrophobicContact CB-CZ3 3.95Å; Q99-W185 HydrophobicContact CG-CE3 4.4Å; Q99-W185 HydrophobicContact CG-CH2 4.39Å; Q99-W185 HydrophobicContact CG-CZ3 4.27Å; L100-W185 HydrophobicContact CD2-CH2 3.89Å; L100-W185 HydrophobicContact CD2-CZ2 4.04Å; L100-W185 HydrophobicContact CG-CH2 4.45Å; H103-W185 HydrophobicContact CB-CZ2 4.29Å; H103-W185 AromaticContact CE1-NE1 3.63Å; H103-W185 AromaticContact CG-NE1 3.69Å; H103-W185 AromaticContact ND1-CD1 3.98Å; H103-W185 AromaticContact ND1-NE1 3.1Å; H103-W185 PolarHBondContact ND1-NE1 3.04Å; I125-W185 HydrophobicContact CD1-CH2 3.53Å; I125-W185 HydrophobicContact CD1-CZ2 4.29Å; I125-W185 HydrophobicContact CD1-CZ3 3.78Å; V127-W185 HydrophobicContact CG1-CB 4.13Å; V127-W185 HydrophobicContact CG1-CD2 4.25Å; V127-W185 HydrophobicContact CG1-CG 4.05Å; V127-W185 HydrophobicContact CG2-CD2 4.26Å; V127-W185 HydrophobicContact CG2-CE3 3.9Å; V127-W185 HydrophobicContact CG2-CZ3 4.13Å; E181-W185 PolarHBondContact O-N 3.42Å; I182-W185 PolarHBondContact O-N 2.98Å
186	F	98.3	Very high	95.8	Very high	10 Å²	10	81.7 Å²	81.7	4%	0.044	37%	0.373	C	S	.	.			trans	-129.6	134.2	-173.3	-71	-94.9	0	0	0	112.5	L60 K91 V127 V129 I182 E190 L191	L60-F186 HydrophobicContact CD1-CD2 4.38Å; L60-F186 HydrophobicContact CD1-CE2 4.28Å; K91-F186 HydrophobicContact CD-CE1 4.15Å; K91-F186 HydrophobicContact CD-CZ 4.48Å; K91-F186 HydrophobicContact CG-CE1 3.89Å; K91-F186 HydrophobicContact CG-CZ 3.9Å; V127-F186 HydrophobicContact CB-CE2 4.2Å; V127-F186 HydrophobicContact CB-CZ 4.35Å; V127-F186 HydrophobicContact CG1-CE2 3.72Å; V127-F186 HydrophobicContact CG1-CZ 4.34Å; V129-F186 HydrophobicContact CG2-CD2 3.53Å; V129-F186 HydrophobicContact CG2-CE2 3.45Å; V129-F186 VanDerWaalsContact CG2-CE2 3.45Å; V129-F186 HydrophobicContact CG2-CG 4.18Å; V129-F186 HydrophobicContact CG2-CZ 4.03Å; I182-F186 PolarHBondContact O-N 3.4Å; F186-E190 WeakPolarHBondContact CA-OE2 3.25Å; F186-E190 HydrophobicContact CD1-CB 3.8Å; F186-L191 HydrophobicContact CB-CD2 3.85Å; F186-L191 HydrophobicContact CB-CG 4.16Å; F186-L191 HydrophobicContact CD1-CD2 3.97Å; F186-L191 HydrophobicContact CG-CD2 3.89Å
187	H	97.6	Very high	95	Very high	130 Å²	130	82 Å²	82	60%	0.602	39%	0.388	S	S	*	.			trans	-73.4	151.3	160.7	-59.9	-61.6	0	0	0	110.2	K189 E190	H187-K189 HydrophobicContact CB-CG 4.14Å; H187-K189 PolarHBondContact O-N 2.82Å; H187-E190 HydrophobicContact CB-CG 4.33Å; H187-E190 IonicContact CD2-OE2 3.55Å; H187-E190 PolarHBondContact CD2-OE2 3.37Å; H187-E190 IonicContact CG-OE2 3.58Å; H187-E190 PolarHBondContact N-OE2 2.83Å; H187-E190 WeakPolarHBondContact O-CB 3.42Å; H187-E190 PolarHBondContact O-N 3.49Å
188	R	95.3	Very high	94	Very high	232 Å²	232	85.2 Å²	85.2	88%	0.875	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-53.3	-35.1	179.3	-170.2	178.2	180	-129.8	-0.7	113.6	E190 L191	R188-E190 VanDerWaalsContact C-N 3.27Å; R188-E190 PolarHBondContact O-N 3.38Å; R188-L191 PolarHBondContact O-N 3.14Å
189	K	96.7	Very high	92.7	Very high	176 Å²	176	89 Å²	89	77%	0.765	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-69.7	-18.9	178.3	68.2	176.8	-178.7	179.1	0	114.5	H187 L191 M192	H187-K189 HydrophobicContact CB-CG 4.14Å; H187-K189 PolarHBondContact O-N 2.82Å; K189-L191 VanDerWaalsContact C-N 3.3Å; K189-M192 WeakPolarHBondContact O-CE 3.26Å
190	E	97.4	Very high	91.5	Very high	61 Å²	61	86 Å²	86	29%	0.285	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-85.7	-8.3	176.5	-61.5	175.5	99.6	0	0	111.7	K91 F186 H187 R188	K91-E190 IonicContact NZ-OE1 3.09Å; K91-E190 PolarHBondContact NZ-OE1 3.14Å; K91-E190 IonicContact NZ-OE2 3.19Å; K91-E190 PolarHBondContact NZ-OE2 3.01Å; F186-E190 WeakPolarHBondContact CA-OE2 3.25Å; F186-E190 HydrophobicContact CD1-CB 3.8Å; H187-E190 HydrophobicContact CB-CG 4.33Å; H187-E190 IonicContact CD2-OE2 3.55Å; H187-E190 PolarHBondContact CD2-OE2 3.37Å; H187-E190 IonicContact CG-OE2 3.58Å; H187-E190 PolarHBondContact N-OE2 2.83Å; H187-E190 WeakPolarHBondContact O-CB 3.42Å; H187-E190 PolarHBondContact O-N 3.49Å; R188-E190 VanDerWaalsContact C-N 3.27Å; R188-E190 PolarHBondContact O-N 3.38Å
191	L	97.9	Very high	90.2	Very high	32 Å²	32	86 Å²	86	17%	0.168	43%	0.43	C	S	.	.	S	Bend	trans	-100	122.4	178.7	-57.8	178.7	0	0	0	109.9	V88 V129 I182 F186 R188 K189	V88-L191 CarbonylContact O-C 3.6Å; V88-L191 WeakPolarHBondContact O-CA 3.33Å; V129-L191 HydrophobicContact CB-CD2 4.18Å; V129-L191 HydrophobicContact CG1-CD2 4.45Å; V129-L191 HydrophobicContact CG2-CD2 3.88Å; I182-L191 HydrophobicContact CG2-CD1 3.91Å; F186-L191 HydrophobicContact CB-CD2 3.85Å; F186-L191 HydrophobicContact CB-CG 4.16Å; F186-L191 HydrophobicContact CD1-CD2 3.97Å; F186-L191 HydrophobicContact CG-CD2 3.89Å; R188-L191 PolarHBondContact O-N 3.14Å; K189-L191 VanDerWaalsContact C-N 3.3Å
192	M	96.2	Very high	88.8	Confident	100 Å²	100	88 Å²	88	49%	0.493	44%	0.444	S	S	.	.			trans	-91.7	139.9	-179.2	-58.9	-61.3	113.9	0	0	110.6	V88 K189	V88-M192 WeakPolarHBondContact CB-O 3.43Å; V88-M192 PolarHBondContact O-N 3.33Å; K189-M192 WeakPolarHBondContact O-CE 3.26Å
193	D	92.9	Very high	87.4	Confident	116 Å²	116	89.1 Å²	89.1	62%	0.62	45%	0.447	S	S	*	.			trans	-111.8	118	165.6	-166.6	17.9	0	0	0	108.2	R56 K86	R56-D193 IonicContact CZ-OD1 3.16Å; R56-D193 IonicContact NH1-OD1 2.73Å; R56-D193 PolarHBondContact NH1-OD1 3.23Å; K86-D193 IonicContact NZ-OD1 2.83Å
194	W	92.8	Very high	85.7	Confident	118 Å²	118	86.4 Å²	86.4	45%	0.447	44%	0.435	S	S	.	.			trans	-149.6	155.3	-176.4	65.8	-81.2	0	0	0	109.7	K86 L87 C196	K86-W194 HydrophobicContact CD-CD2 4.11Å; K86-W194 HydrophobicContact CD-CG 4.41Å; K86-W194 HydrophobicContact CD-CZ2 4.14Å; K86-W194 WeakPolarHBondContact CD-O 3.23Å; K86-W194 HydrophobicContact CG-CD2 4.42Å; K86-W194 HydrophobicContact CG-CH2 4.3Å; K86-W194 HydrophobicContact CG-CZ2 3.56Å; K86-W194 PolarHBondContact NZ-O 3.15Å; L87-W194 PolarHBondContact O-NE1 3.38Å; W194-C196 HydrophobicContact CZ3-CB 4.28Å
195	D	86.7	Confident	83.5	Confident	138 Å²	138	95.4 Å²	95.4	74%	0.738	48%	0.48	S	S	*	.			trans	-95.4	127.5	-177.6	-64	-41.7	0	0	0	110.7
196	C	80.9	Confident	82.8	Confident	26 Å²	26	99.9 Å²	99.9	18%	0.176	50%	0.503	C	S	.	.			trans	-81.2	134.7	172.3	-54.2	0	0	0	0	110.1	K86 W194 D198 H199	K86-C196 WeakPolarHBondContact CD-SG 3.43Å; K86-C196 VanDerWaalsContact CG-SG 3.56Å; W194-C196 HydrophobicContact CZ3-CB 4.28Å; C196-D198 WeakPolarHBondContact CB-OD1 3.47Å; C196-D198 PolarHBondContact O-N 3.21Å; C196-H199 WeakPolarHBondContact O-CB 3.47Å; C196-H199 PolarHBondContact O-N 3.05Å; C196-H199 VanDerWaalsContact O-N 3.16Å
197	C	79.6	Confident	82	Confident	133 Å²	133	104.6 Å²	104.6	90%	0.899	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.3	179	64	0	0	0	0	114.1
198	D	76.4	Confident	81.1	Confident	66 Å²	66	103.2 Å²	103.2	35%	0.353	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	2.8	179.6	64.3	-15.2	0	0	0	113.1	C196 S200 S201 T202	C196-D198 WeakPolarHBondContact CB-OD1 3.47Å; C196-D198 PolarHBondContact O-N 3.21Å; D198-S200 PolarHBondContact O-N 3.5Å; D198-S200 VanDerWaalsContact O-N 3.12Å; D198-S201 WeakPolarHBondContact O-CA 3.5Å; D198-S201 WeakPolarHBondContact O-CB 3.43Å; D198-S201 PolarHBondContact O-N 2.85Å; D198-T202 PolarHBondContact O-N 3.02Å; D198-T202 PolarHBondContact O-OG1 2.86Å; D198-T202 VanDerWaalsContact O-OG1 3.07Å
199	H	72.1	Confident	80.3	Confident	79 Å²	79	95.6 Å²	95.6	37%	0.366	50%	0.503	S	S	.	.	H	α-helix	trans	-54.9	-38.6	-174	-169	76.5	0	0	0	113.2	C196 T202 Y203	C196-H199 WeakPolarHBondContact O-CB 3.47Å; C196-H199 PolarHBondContact O-N 3.05Å; C196-H199 VanDerWaalsContact O-N 3.16Å; H199-T202 PolarHBondContact O-N 3.29Å; H199-Y203 AromaticContact CE1-CD2 3.56Å; H199-Y203 AromaticContact ND1-CD2 3.47Å; H199-Y203 WeakPolarHBondContact ND1-CD2 3.38Å; H199-Y203 AromaticContact ND1-CE2 3.91Å; H199-Y203 PolarHBondContact O-N 3.12Å
200	S	71.3	Confident	79.2	Confident	51 Å²	51	90.6 Å²	90.6	36%	0.357	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-42.4	174.2	50.6	0	0	0	0	112.2	D198 T202 Q204	D198-S200 PolarHBondContact O-N 3.5Å; D198-S200 VanDerWaalsContact O-N 3.12Å; S200-T202 VanDerWaalsContact C-N 3.31Å; S200-T202 PolarHBondContact O-N 3.22Å; S200-Q204 WeakPolarHBondContact O-CB 3.26Å; S200-Q204 PolarHBondContact O-N 3.16Å
201	S	70.6	Confident	78	Confident	104 Å²	104	92.6 Å²	92.6	73%	0.727	50%	0.5	S	S	*	.	H	α-helix	trans	-73	-24.2	-177.5	-52.1	0	0	0	0	112.9	D198	D198-S201 WeakPolarHBondContact O-CA 3.5Å; D198-S201 WeakPolarHBondContact O-CB 3.43Å; D198-S201 PolarHBondContact O-N 2.85Å
202	T	69	Low	76.6	Confident	60 Å²	60	96.9 Å²	96.9	37%	0.368	52%	0.523	S	S	.	.	H	α-helix	trans	-95.2	-29.3	-176.5	-46.3	0	0	0	0	113	D198 H199 S200	D198-T202 PolarHBondContact O-N 3.02Å; D198-T202 PolarHBondContact O-OG1 2.86Å; D198-T202 VanDerWaalsContact O-OG1 3.07Å; H199-T202 PolarHBondContact O-N 3.29Å; S200-T202 VanDerWaalsContact C-N 3.31Å; S200-T202 PolarHBondContact O-N 3.22Å
203	Y	69.3	Low	75.1	Confident	40 Å²	40	96.7 Å²	96.7	16%	0.157	53%	0.526	C	S	.	.	H	α-helix	trans	-130.2	-8.7	-171.1	-60.5	-71.1	0	0	0	115.8	I52 V55 G132 Y133 H199	I52-Y203 WeakPolarHBondContact CD1-O 3.29Å; V55-Y203 HydrophobicContact CG1-CD1 4.22Å; V55-Y203 HydrophobicContact CG1-CD2 4.16Å; V55-Y203 HydrophobicContact CG1-CE1 4.29Å; V55-Y203 HydrophobicContact CG1-CE2 4.23Å; V55-Y203 HydrophobicContact CG1-CG 4.15Å; V55-Y203 HydrophobicContact CG2-CD1 3.96Å; V55-Y203 HydrophobicContact CG2-CE1 4.34Å; V55-Y203 HydrophobicContact CG2-CG 4.41Å; G132-Y203 WeakPolarHBondContact CA-OH 3.42Å; Y133-Y203 PolarHBondContact N-OH 3.46Å; H199-Y203 AromaticContact CE1-CD2 3.56Å; H199-Y203 AromaticContact ND1-CD2 3.47Å; H199-Y203 WeakPolarHBondContact ND1-CD2 3.38Å; H199-Y203 AromaticContact ND1-CE2 3.91Å; H199-Y203 PolarHBondContact O-N 3.12Å
204	Q	62.2	Low	73.6	Confident	95 Å²	95	95.1 Å²	95.1	44%	0.444	52%	0.518	S	S	.	.			trans	-85.9	139.1	171.5	-65.2	174	-12.2	0	0	110.3	S200	S200-Q204 WeakPolarHBondContact O-CB 3.26Å; S200-Q204 PolarHBondContact O-N 3.16Å
205	I	52.7	Low	71.9	Confident	231 Å²	231	93 Å²	93	100%	1.185	52%	0.524	S	S	*	.			trans	-89.2	0	170.4	-57.6	175.6	0	0	0	108.1

Retrieved 205 of 205 residues in 82.7 ms (Link to these results)

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