A0A3Q0KJI1_SCHMA Loading...

Universal stress protein, putative

AlphaFold DB , UniProt , Accession A0A3Q0KJI1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 196 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	34.9	Very low	34.5	Very low	237 Å²	237	108.3 Å²	108.3	100%	1.167	61%	0.605	S	S	*	*				0	122.9	0	-75.5	168.8	165	0	0	108	N3	M1-N3 PolarHBondContact O-N 3.01Å
2	S	41.8	Very low	33.6	Very low	77 Å²	77	111.8 Å²	111.8	54%	0.538	62%	0.62	S	S	.	*			trans	-82.7	110.5	-178.5	-169.4	0	0	0	0	108.7	Q4	S2-Q4 PolarHBondContact O-N 2.99Å
3	N	39	Very low	32.8	Very low	127 Å²	127	114.1 Å²	114.1	68%	0.679	63%	0.629	S	S	*	*			trans	-71.6	90	174.6	-76.2	-12.8	0	0	0	109.1	M1	M1-N3 PolarHBondContact O-N 3.01Å
4	Q	39.7	Very low	32.1	Very low	85 Å²	85	109.5 Å²	109.5	40%	0.397	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.9	132.7	175.2	-77.2	-173.8	-10.7	0	0	110.7	S2 H137	S2-Q4 PolarHBondContact O-N 2.99Å; Q4-H137 PolarHBondContact NE2-CE1 3.39Å; Q4-H137 VanDerWaalsContact NE2-CE1 3.29Å; Q4-H137 PolarHBondContact NE2-NE2 3.02Å
5	I	38.6	Very low	31.5	Very low	97 Å²	97	106.6 Å²	106.6	50%	0.497	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.9	114.8	168.3	-58	173.3	0	0	0	106.8
6	K	34.7	Very low	31.1	Very low	119 Å²	119	109.2 Å²	109.2	52%	0.517	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	131.3	174.8	-174.1	171.9	-176.6	164.5	0	109.5	Q133 F135	K6-Q133 VanDerWaalsContact CE-OE1 3.28Å; K6-Q133 VanDerWaalsContact NZ-NE2 3.15Å; K6-Q133 VanDerWaalsContact NZ-OE1 3.16Å; K6-F135 HydrophobicContact CG-CE1 4.46Å
7	L	37.3	Very low	30.7	Very low	58 Å²	58	111.8 Å²	111.8	30%	0.304	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-94.5	133.6	169.9	-70.2	165	0	0	0	109.5	L122 A134	L7-L122 HydrophobicContact CB-CD1 4.28Å; L7-L122 HydrophobicContact CD1-CD1 4.13Å; L7-A134 HydrophobicContact CD1-CB 4.29Å
8	A	33.6	Very low	30.4	Very low	102 Å²	102	112.7 Å²	112.7	84%	0.843	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-76.4	156.1	-166.9	0	0	0	0	0	115.3
9	N	28.9	Very low	30.1	Very low	83 Å²	83	113.1 Å²	113.1	44%	0.444	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-84.4	160.7	-162.5	-64.2	-37.7	0	0	0	115.8	Q133	N9-Q133 VanDerWaalsContact OD1-CG 3.31Å; N9-Q133 WeakPolarHBondContact OD1-CG 2.95Å; N9-Q133 PolarHBondContact OD1-NE2 3.41Å
10	T	27.9	Very low	29.8	Very low	107 Å²	107	117.9 Å²	117.9	66%	0.656	66%	0.658	S	S	*	*			trans	-153.5	131.5	145.2	-32.8	0	0	0	0	111.5
11	T	22.9	Very low	29.6	Very low	99 Å²	99	119.2 Å²	119.2	61%	0.607	66%	0.663	S	S	*	*			trans	-98.3	138.1	-170.8	-54.8	0	0	0	0	112.3
12	L	23.9	Very low	29.1	Very low	150 Å²	150	112.8 Å²	112.8	79%	0.785	64%	0.641	S	S	*	*			trans	-152.4	145.7	154.1	-78.4	-177.1	0	0	0	112.2
13	L	23	Very low	28.2	Very low	142 Å²	142	116.5 Å²	116.5	74%	0.743	66%	0.655	S	S	*	*			trans	-88.4	145.2	-171.4	-60.4	110.4	0	0	0	113.6
14	G	23	Very low	27.7	Very low	50 Å²	50	121.4 Å²	121.4	52%	0.515	66%	0.664	S	S	.	*			trans	-166.9	115.9	161.5	0	0	0	0	0	118.2	K72	G14-K72 VanDerWaalsContact C-CD 3.41Å; G14-K72 WeakPolarHBondContact O-CB 3.17Å; G14-K72 WeakPolarHBondContact O-CG 3.13Å
15	S	23.5	Very low	26.9	Very low	66 Å²	66	124.1 Å²	124.1	46%	0.462	68%	0.68	S	S	.	*			trans	-86.8	160.2	-168.2	37.1	0	0	0	0	115.6	K72	S15-K72 VanDerWaalsContact N-CD 3.33Å; S15-K72 PolarHBondContact OG-NZ 2.78Å
16	N	25.5	Very low	26.3	Very low	148 Å²	148	129.1 Å²	129.1	79%	0.791	69%	0.694	S	S	*	*				169.5	159.1	113.2	-79.1	-20.8	0	0	0	112.6
17	N	23.4	Very low	25.8	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	71%	0.71	S	S	*	*			trans	-63.7	154.8	-176.2	-64.4	-40.2	0	0	0	115.7
18	T	25.4	Very low	25.5	Very low	128 Å²	128	136.3 Å²	136.3	79%	0.785	73%	0.73	S	S	*	*			trans	-163.7	133.5	139.2	29.1	0	0	0	0	112
19	P	24.2	Very low	25.3	Very low	120 Å²	120	139.6 Å²	139.6	78%	0.779	73%	0.732	S	S	*	*			trans	-100.2	141.2	173	34.8	-27.4	0	0	0	112.8
20	Y	25.4	Very low	25.4	Very low	208 Å²	208	143.7 Å²	143.7	82%	0.816	74%	0.741	S	S	*	*			trans	-136	107.6	173.3	-98.2	-86.9	0	0	0	113.7
21	L	25.8	Very low	25.6	Very low	147 Å²	147	144.1 Å²	144.1	77%	0.77	75%	0.746	S	S	*	*			trans	35.6	110.4	130.2	-65.6	162.4	0	0	0	123.1
22	S	24.2	Very low	26.1	Very low	101 Å²	101	149.6 Å²	149.6	71%	0.706	76%	0.761	S	S	*	*				36.2	122.1	128.4	75.1	0	0	0	0	124.9
23	N	22.8	Very low	26.5	Very low	155 Å²	155	149.9 Å²	149.9	83%	0.829	76%	0.756	S	S	*	*				43	110.2	127.4	-70.2	-8.4	0	0	0	122.3
24	R	27.8	Very low	26.8	Very low	231 Å²	231	151.4 Å²	151.4	87%	0.872	76%	0.757	S	S	*	*			trans	-146.5	134.4	134.3	-86.3	-165.7	-166.8	-155.6	2.4	111.3
25	I	23.5	Very low	27.3	Very low	141 Å²	141	154.7 Å²	154.7	72%	0.723	77%	0.766	S	S	*	*			trans	-83.2	125.3	-175.2	-62.7	163.6	0	0	0	109.5
26	Y	25.8	Very low	27.9	Very low	203 Å²	203	158 Å²	158	80%	0.796	77%	0.773	S	S	*	*			trans	-135.3	110.5	158.9	-79.3	-78.1	0	0	0	109.3	F28	Y26-F28 PolarHBondContact O-N 3.02Å; Y26-F28 VanDerWaalsContact O-N 3.14Å
27	N	24.3	Very low	28.3	Very low	161 Å²	161	156.8 Å²	156.8	86%	0.861	77%	0.771	S	S	*	*			trans	-75.5	92.7	175	-70.3	-32.2	0	0	0	109.3
28	F	30	Very low	29.4	Very low	166 Å²	166	152.5 Å²	152.5	73%	0.728	75%	0.747	S	S	*	*			trans	-125.4	121.7	166.2	-164.1	-97.6	0	0	0	108.4	Y26 R30	Y26-F28 PolarHBondContact O-N 3.02Å; Y26-F28 VanDerWaalsContact O-N 3.14Å; F28-R30 VanDerWaalsContact C-N 3.27Å; F28-R30 HydrophobicContact CD1-CG 3.98Å; F28-R30 PolarHBondContact O-N 3.49Å
29	I	31.1	Very low	30.5	Very low	171 Å²	171	149.6 Å²	149.6	88%	0.877	74%	0.742	S	S	*	*			trans	-65.5	86.6	-177.3	-56.9	167.6	0	0	0	107.9
30	R	30.4	Very low	31.5	Very low	170 Å²	170	148.9 Å²	148.9	64%	0.642	74%	0.735	S	S	*	*			trans	-88.3	142.1	170	-69.8	-169.6	177.7	175.6	-1.5	108.2	F28 K32	F28-R30 VanDerWaalsContact C-N 3.27Å; F28-R30 HydrophobicContact CD1-CG 3.98Å; F28-R30 PolarHBondContact O-N 3.49Å; R30-K32 PolarHBondContact O-N 3.27Å
31	P	31.2	Very low	32.6	Very low	116 Å²	116	143 Å²	143	75%	0.753	72%	0.718	S	S	*	*			trans	-49.4	137.8	173.9	23.5	-33.7	0	0	0	107.9	K33	P31-K33 VanDerWaalsContact C-N 3.26Å; P31-K33 PolarHBondContact O-N 2.79Å
32	K	33.8	Very low	33.8	Very low	213 Å²	213	142.7 Å²	142.7	93%	0.926	72%	0.722	S	S	*	*			trans	-47.1	93.1	-174.1	-72.1	-164.5	178.8	-175.8	0	109.4	R30 K34	R30-K32 PolarHBondContact O-N 3.27Å; K32-K34 PolarHBondContact O-N 3.03Å
33	K	32.6	Very low	35.4	Very low	157 Å²	157	144 Å²	144	68%	0.683	72%	0.717	S	S	*	*			trans	-63	110.4	167.4	-90	-170.5	174.8	-170.3	0	102.3	P31 V35	P31-K33 VanDerWaalsContact C-N 3.26Å; P31-K33 PolarHBondContact O-N 2.79Å; K33-V35 HydrophobicContact CB-CG2 4.34Å; K33-V35 PolarHBondContact O-N 2.76Å
34	K	29	Very low	37.8	Very low	174 Å²	174	141.2 Å²	141.2	76%	0.757	70%	0.702	S	S	*	*			trans	-60.5	94.1	160.3	-124.4	177.6	179.3	-178.8	0	104.3	K32 F36	K32-K34 PolarHBondContact O-N 3.03Å; K34-F36 HydrophobicContact CB-CD2 4.18Å; K34-F36 HydrophobicContact CB-CE2 3.83Å; K34-F36 HydrophobicContact CD-CE2 4Å; K34-F36 HydrophobicContact CD-CZ 3.93Å; K34-F36 HydrophobicContact CG-CE2 4.29Å; K34-F36 WeakPolarHBondContact O-CD2 3.32Å; K34-F36 PolarHBondContact O-N 3.36Å
35	V	32.9	Very low	40.6	Very low	118 Å²	118	133.7 Å²	133.7	72%	0.715	68%	0.676	S	S	*	*			trans	-71.3	95.8	171.4	178.2	0	0	0	0	103.7	K33 T37	K33-V35 HydrophobicContact CB-CG2 4.34Å; K33-V35 PolarHBondContact O-N 2.76Å; V35-T37 PolarHBondContact O-N 2.93Å
36	F	36	Very low	43.9	Very low	136 Å²	136	128.4 Å²	128.4	60%	0.596	65%	0.648	S	S	*	*			trans	-70.6	107.7	165.4	-74.9	-87.5	0	0	0	105.9	K34 M38	K34-F36 HydrophobicContact CB-CD2 4.18Å; K34-F36 HydrophobicContact CB-CE2 3.83Å; K34-F36 HydrophobicContact CD-CE2 4Å; K34-F36 HydrophobicContact CD-CZ 3.93Å; K34-F36 HydrophobicContact CG-CE2 4.29Å; K34-F36 WeakPolarHBondContact O-CD2 3.32Å; K34-F36 PolarHBondContact O-N 3.36Å; F36-M38 PolarHBondContact O-N 3.05Å
37	T	35.6	Very low	47.3	Very low	122 Å²	122	119.8 Å²	119.8	75%	0.748	62%	0.616	S	S	*	*			trans	-62.5	116.7	158	48.7	0	0	0	0	105.6	V35 G39	V35-T37 PolarHBondContact O-N 2.93Å; T37-G39 PolarHBondContact O-N 3.22Å; T37-G39 VanDerWaalsContact O-N 3.11Å
38	M	46.5	Very low	50.8	Low	65 Å²	65	112.1 Å²	112.1	32%	0.32	58%	0.575	S	S	.	*			trans	-50.6	125	167.1	-88.4	162.4	84.9	0	0	106.3	F36 V40 K46 D156 I157	F36-M38 PolarHBondContact O-N 3.05Å; M38-V40 VanDerWaalsContact O-CG2 3.31Å; M38-V40 WeakPolarHBondContact O-CG2 3.36Å; M38-V40 PolarHBondContact O-N 3.37Å; M38-K46 HydrophobicContact CE-CD 3.5Å; M38-K46 VanDerWaalsContact CE-CD 3.5Å; M38-K46 HydrophobicContact CE-CG 4.09Å; M38-D156 HydrophobicContact CE-CB 4.36Å; M38-I157 HydrophobicContact CE-CB 4.34Å
39	G	47.4	Very low	54.1	Low	66 Å²	66	104.2 Å²	104.2	68%	0.68	54%	0.54	S	S	*	.			trans	-61.1	95	168.7	0	0	0	0	0	105.8	T37 N41	T37-G39 PolarHBondContact O-N 3.22Å; T37-G39 VanDerWaalsContact O-N 3.11Å; G39-N41 VanDerWaalsContact C-N 3.31Å; G39-N41 PolarHBondContact O-N 3Å
40	V	45.4	Very low	57.3	Low	106 Å²	106	96 Å²	96	64%	0.642	50%	0.499	S	S	*	.			trans	-72	100.8	178.1	-143.7	0	0	0	0	104	M38 T42	M38-V40 VanDerWaalsContact O-CG2 3.31Å; M38-V40 WeakPolarHBondContact O-CG2 3.36Å; M38-V40 PolarHBondContact O-N 3.37Å; V40-T42 PolarHBondContact O-N 3.23Å
41	N	48.1	Very low	60.5	Low	83 Å²	83	88.3 Å²	88.3	44%	0.444	47%	0.471	S	S	.	.			trans	-50.7	136.2	165.9	-176.6	-7.2	0	0	0	107	G39 E43 N44	G39-N41 VanDerWaalsContact C-N 3.31Å; G39-N41 PolarHBondContact O-N 3Å; N41-E43 PolarHBondContact O-N 3.29Å; N41-E43 PolarHBondContact OD1-N 3Å; N41-N44 WeakPolarHBondContact O-CA 3.31Å; N41-N44 PolarHBondContact O-N 3.47Å
42	T	51.3	Low	63.7	Low	142 Å²	142	83.2 Å²	83.2	87%	0.871	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-24.7	-177.5	57	0	0	0	0	113.4	V40 N44	V40-T42 PolarHBondContact O-N 3.23Å; T42-N44 PolarHBondContact O-N 3.35Å
43	E	58	Low	66.6	Low	129 Å²	129	74.5 Å²	74.5	60%	0.603	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-0.5	174.1	-61.3	-168.9	168.3	0	0	114.5	N41 K45 N73	N41-E43 PolarHBondContact O-N 3.29Å; N41-E43 PolarHBondContact OD1-N 3Å; E43-K45 HydrophobicContact CB-CB 4.43Å; E43-K45 PolarHBondContact O-N 3.18Å; E43-N73 PolarHBondContact O-ND2 3.42Å
44	N	73.7	Confident	69.6	Low	96 Å²	96	70 Å²	70	51%	0.513	39%	0.393	S	S	.	.			trans	51.1	24.8	-173.2	-155.5	10.1	0	0	0	113.3	N41 T42	N41-N44 WeakPolarHBondContact O-CA 3.31Å; N41-N44 PolarHBondContact O-N 3.47Å; T42-N44 PolarHBondContact O-N 3.35Å
45	K	85.6	Confident	72.7	Confident	72 Å²	72	62.3 Å²	62.3	31%	0.313	36%	0.361	S	S	.	.			trans	-81.5	128.5	173.7	171.7	165.5	-172.9	-172.8	0	108.9	E43 N73 E75	E43-K45 HydrophobicContact CB-CB 4.43Å; E43-K45 PolarHBondContact O-N 3.18Å; K45-N73 HydrophobicContact CB-CB 4.07Å; K45-N73 VanDerWaalsContact CG-O 3.32Å; K45-N73 WeakPolarHBondContact CG-O 3.32Å; K45-E75 WeakPolarHBondContact CE-OE2 3.45Å; K45-E75 IonicContact NZ-OE2 2.79Å; K45-E75 PolarHBondContact NZ-OE2 3.37Å
46	K	92.7	Very high	75.6	Confident	30 Å²	30	63.2 Å²	63.2	13%	0.13	36%	0.362	C	S	.	.			trans	-120.6	136.8	173.5	-60.8	170.6	-67.1	-177.8	0	110.2	M38 V48 L69 D74 E75 D156	M38-K46 HydrophobicContact CE-CD 3.5Å; M38-K46 VanDerWaalsContact CE-CD 3.5Å; M38-K46 HydrophobicContact CE-CG 4.09Å; K46-V48 HydrophobicContact CB-CG2 4.34Å; K46-L69 PolarHBondContact NZ-O 2.93Å; K46-D74 WeakPolarHBondContact CE-OD1 3.44Å; K46-D74 IonicContact NZ-OD1 3.08Å; K46-D74 IonicContact NZ-OD2 3.84Å; K46-D74 WeakPolarHBondContact O-CA 3.16Å; K46-E75 PolarHBondContact O-N 3.38Å; K46-D156 VanDerWaalsContact CA-OD2 3.27Å; K46-D156 WeakPolarHBondContact CA-OD2 3.35Å; K46-D156 HydrophobicContact CB-CB 4.35Å
47	V	97.4	Very high	78.4	Confident	22 Å²	22	58.6 Å²	58.6	13%	0.133	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	111.6	164	-179.1	0	0	0	0	108.1	E75 D156 I157	V47-E75 WeakPolarHBondContact CA-O 3.06Å; V47-D156 PolarHBondContact N-OD2 3.04Å; V47-D156 PolarHBondContact O-N 2.94Å; V47-I157 PolarHBondContact O-N 3.31Å
48	V	98.2	Very high	81.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.5	-179.3	-179.4	0	0	0	0	109	K46 L50 Y65 D74 E75 L76 H77 I157 I159	K46-V48 HydrophobicContact CB-CG2 4.34Å; V48-L50 HydrophobicContact CG1-CD1 3.96Å; V48-L50 HydrophobicContact CG1-CG 4.49Å; V48-Y65 HydrophobicContact CB-CE2 4.38Å; V48-Y65 HydrophobicContact CG1-CD2 3.96Å; V48-Y65 HydrophobicContact CG1-CE2 4.05Å; V48-Y65 HydrophobicContact CG2-CD2 4.48Å; V48-Y65 HydrophobicContact CG2-CE2 3.82Å; V48-D74 HydrophobicContact CG2-CB 4.35Å; V48-E75 PolarHBondContact N-O 3.1Å; V48-L76 HydrophobicContact CB-CD1 3.55Å; V48-L76 HydrophobicContact CB-CG 4.12Å; V48-L76 HydrophobicContact CG1-CD1 4.02Å; V48-L76 HydrophobicContact CG1-CG 4.32Å; V48-L76 HydrophobicContact CG2-CD1 3.93Å; V48-L76 WeakPolarHBondContact O-CA 3.34Å; V48-H77 PolarHBondContact O-N 3.36Å; V48-I157 HydrophobicContact CB-CG2 4.25Å; V48-I157 HydrophobicContact CG1-CG2 4.07Å; V48-I157 HydrophobicContact CG2-CG2 3.95Å; V48-I159 HydrophobicContact CG1-CD1 3.55Å; V48-I159 HydrophobicContact CG1-CG1 4.13Å
49	F	98.6	Very high	83.8	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120	-177.5	-166	-91.9	0	0	0	110.7	P51 H77 V79 L146 F149 A150 Q153 A155 I157 I158 I159	F49-P51 HydrophobicContact CD1-CG 3.93Å; F49-P51 HydrophobicContact CE1-CG 3.9Å; F49-P51 WeakPolarHBondContact O-CD 3.31Å; F49-H77 HydrophobicContact CD2-CB 4.15Å; F49-V79 HydrophobicContact CD2-CG2 4.15Å; F49-V79 HydrophobicContact CE1-CB 4.41Å; F49-V79 HydrophobicContact CE1-CG2 4.11Å; F49-V79 HydrophobicContact CE2-CG2 3.5Å; F49-V79 VanDerWaalsContact CE2-CG2 3.5Å; F49-V79 HydrophobicContact CZ-CB 4.06Å; F49-V79 HydrophobicContact CZ-CG1 4.29Å; F49-V79 HydrophobicContact CZ-CG2 3.49Å; F49-V79 VanDerWaalsContact CZ-CG2 3.49Å; F49-L146 HydrophobicContact CE1-CB 4.45Å; F49-L146 HydrophobicContact CE1-CD2 3.99Å; F49-L146 HydrophobicContact CZ-CD2 4.33Å; F49-F149 HydrophobicContact CE2-CB 4.45Å; F49-F149 AromaticContact CE2-CD1 3.47Å; F49-F149 HydrophobicContact CE2-CD1 3.47Å; F49-F149 VanDerWaalsContact CE2-CD1 3.47Å; F49-F149 AromaticContact CE2-CE1 3.95Å; F49-F149 HydrophobicContact CE2-CE1 3.95Å; F49-F149 HydrophobicContact CE2-CG 4.2Å; F49-F149 HydrophobicContact CZ-CB 4.16Å; F49-F149 AromaticContact CZ-CD1 3.61Å; F49-F149 HydrophobicContact CZ-CD1 3.61Å; F49-F149 HydrophobicContact CZ-CE1 4.44Å; F49-F149 HydrophobicContact CZ-CG 4.28Å; F49-A150 HydrophobicContact CD1-CB 3.97Å; F49-A150 HydrophobicContact CD2-CB 4.2Å; F49-A150 HydrophobicContact CE1-CB 3.95Å; F49-A150 HydrophobicContact CE2-CB 4.17Å; F49-A150 HydrophobicContact CG-CB 4.07Å; F49-A150 HydrophobicContact CZ-CB 4.04Å; F49-Q153 HydrophobicContact CE2-CG 4.45Å; F49-A155 HydrophobicContact CB-CB 3.65Å; F49-A155 HydrophobicContact CD2-CB 4.35Å; F49-A155 HydrophobicContact CG-CB 4.26Å; F49-I157 PolarHBondContact N-O 2.83Å; F49-I158 HydrophobicContact CB-CG1 4.2Å; F49-I158 HydrophobicContact CD1-CG1 4.18Å; F49-I158 HydrophobicContact CD1-CG2 4.31Å; F49-I158 CarbonylContact O-C 3.58Å; F49-I158 WeakPolarHBondContact O-CA 3.48Å; F49-I159 PolarHBondContact O-N 2.89Å
50	L	98.6	Very high	86.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	93.3	-174.3	-95.1	146.3	0	0	0	110.5	V48 V52 A61 F62 Y65 L76 H77 F78 V79 I159	V48-L50 HydrophobicContact CG1-CD1 3.96Å; V48-L50 HydrophobicContact CG1-CG 4.49Å; L50-V52 PolarHBondContact O-N 3.36Å; L50-A61 HydrophobicContact CD2-CB 4.35Å; L50-F62 HydrophobicContact CD1-CD2 4.18Å; L50-F62 HydrophobicContact CD2-CB 4.34Å; L50-Y65 HydrophobicContact CD1-CG 4.45Å; L50-L76 HydrophobicContact CD1-CD2 3.71Å; L50-L76 HydrophobicContact CD1-CG 3.98Å; L50-H77 PolarHBondContact N-O 3.29Å; L50-F78 HydrophobicContact CB-CD1 3.87Å; L50-F78 HydrophobicContact CB-CE1 4.14Å; L50-F78 HydrophobicContact CD1-CE1 4.12Å; L50-F78 WeakPolarHBondContact O-CA 3.42Å; L50-V79 PolarHBondContact O-N 3.17Å; L50-I159 HydrophobicContact CD2-CB 3.96Å; L50-I159 HydrophobicContact CD2-CG2 4.06Å; L50-I159 WeakPolarHBondContact CD2-O 3.2Å; L50-I159 HydrophobicContact CG-CB 4.08Å
51	P	98.6	Very high	88.6	Confident	8 Å²	8	46.8 Å²	46.8	5%	0.052	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	124.9	168.1	-19.4	33.4	0	0	0	110.1	F49 V79 L146 I158 I159 I160	F49-P51 HydrophobicContact CD1-CG 3.93Å; F49-P51 HydrophobicContact CE1-CG 3.9Å; F49-P51 WeakPolarHBondContact O-CD 3.31Å; P51-V79 WeakPolarHBondContact CA-O 3.39Å; P51-L146 HydrophobicContact CB-CD1 3.63Å; P51-L146 HydrophobicContact CB-CD2 3.74Å; P51-L146 HydrophobicContact CB-CG 4.29Å; P51-L146 HydrophobicContact CG-CD1 3.98Å; P51-L146 HydrophobicContact CG-CD2 3.93Å; P51-L146 HydrophobicContact CG-CG 4.41Å; P51-I158 HydrophobicContact CG-CG2 4.15Å; P51-I159 WeakPolarHBondContact CD-O 3.49Å; P51-I160 HydrophobicContact CB-CD1 3.92Å; P51-I160 HydrophobicContact CB-CG1 4.09Å; P51-I160 HydrophobicContact CG-CB 4.48Å; P51-I160 HydrophobicContact CG-CD1 3.95Å; P51-I160 HydrophobicContact CG-CG1 4.18Å
52	V	98.1	Very high	91	Very high	8 Å²	8	42.8 Å²	42.8	5%	0.048	24%	0.236	C	C	.	.			trans	-126.2	145.7	-177.4	-65.5	0	0	0	0	111.6	L50 S58 F78 V79 Y80 L118 Y121	L50-V52 PolarHBondContact O-N 3.36Å; V52-S58 WeakPolarHBondContact CA-OG 3.27Å; V52-F78 HydrophobicContact CG1-CD1 3.96Å; V52-F78 HydrophobicContact CG2-CB 4.38Å; V52-V79 PolarHBondContact N-O 3.28Å; V52-Y80 WeakPolarHBondContact O-CD2 3.48Å; V52-L118 HydrophobicContact CG2-CD2 3.68Å; V52-Y121 HydrophobicContact CB-CD2 4.39Å; V52-Y121 HydrophobicContact CB-CE2 3.88Å; V52-Y121 HydrophobicContact CG1-CD1 4.41Å; V52-Y121 HydrophobicContact CG1-CD2 4.41Å; V52-Y121 HydrophobicContact CG1-CE1 4.03Å; V52-Y121 HydrophobicContact CG1-CE2 4.03Å; V52-Y121 HydrophobicContact CG2-CD2 4.19Å; V52-Y121 HydrophobicContact CG2-CE2 4.11Å
53	D	95.3	Very high	93.3	Very high	31 Å²	31	38.8 Å²	38.8	17%	0.166	21%	0.208	C	C	.	.			trans	-132.5	-171.2	160.8	71	4	0	0	0	110.4	S55 S58 Y80 L117 G164 L165	D53-S55 PolarHBondContact O-N 2.82Å; D53-S55 VanDerWaalsContact O-N 3.14Å; D53-S55 WeakPolarHBondContact OD1-CB 3.35Å; D53-S55 PolarHBondContact OD1-N 2.68Å; D53-S55 PolarHBondContact OD1-OG 3.08Å; D53-S58 PolarHBondContact N-OG 3.39Å; D53-S58 PolarHBondContact OD1-OG 2.89Å; D53-Y80 HydrophobicContact CB-CD2 4.49Å; D53-Y80 HydrophobicContact CB-CE2 3.96Å; D53-L117 VanDerWaalsContact C-CD2 3.43Å; D53-G164 WeakPolarHBondContact OD2-CA 3.45Å; D53-L165 PolarHBondContact OD2-N 2.83Å
54	A	94.5	Very high	95.2	Very high	63 Å²	63	36.4 Å²	36.4	52%	0.521	19%	0.193	S	C	.	.	S	Bend	trans	-77	12.8	-179.4	0	0	0	0	0	113.8	L117 L165	A54-L117 HydrophobicContact CB-CD1 4.41Å; A54-L117 HydrophobicContact CB-CD2 4.42Å; A54-L165 HydrophobicContact CB-CD1 4.05Å; A54-L165 HydrophobicContact CB-CD2 4.45Å
55	S	94.8	Very high	96.3	Very high	11 Å²	11	31.9 Å²	31.9	8%	0.077	17%	0.169	C	C	.	.	S	Bend	trans	-85.2	151.6	-180	73.9	0	0	0	0	113.2	D53 H57 S58 A59	D53-S55 PolarHBondContact O-N 2.82Å; D53-S55 VanDerWaalsContact O-N 3.14Å; D53-S55 WeakPolarHBondContact OD1-CB 3.35Å; D53-S55 PolarHBondContact OD1-N 2.68Å; D53-S55 PolarHBondContact OD1-OG 3.08Å; S55-H57 PolarHBondContact O-N 3.19Å; S55-H57 VanDerWaalsContact O-N 3.16Å; S55-S58 PolarHBondContact O-N 3Å; S55-S58 VanDerWaalsContact O-N 3.11Å; S55-S58 PolarHBondContact OG-N 2.74Å; S55-A59 PolarHBondContact O-N 3.44Å
56	D	93.6	Very high	96.8	Very high	138 Å²	138	29 Å²	29	74%	0.738	16%	0.157	S	C	*	.	H	α-helix	trans	-59.5	-26	171.5	-63.5	-30.9	0	0	0	112.4	A59 R60	D56-A59 PolarHBondContact O-N 2.76Å; D56-R60 VanDerWaalsContact O-CB 3.23Å; D56-R60 WeakPolarHBondContact O-CB 3.39Å; D56-R60 PolarHBondContact O-N 3.22Å
57	H	94.9	Very high	97	Very high	39 Å²	39	32.6 Å²	32.6	18%	0.181	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-39.4	176.9	-63.7	-58.8	0	0	0	112.3	S55 R60 A61 R163	S55-H57 PolarHBondContact O-N 3.19Å; S55-H57 VanDerWaalsContact O-N 3.16Å; H57-R60 PolarHBondContact O-N 3.07Å; H57-A61 WeakPolarHBondContact O-CB 3.42Å; H57-A61 PolarHBondContact O-N 3.09Å; H57-R163 WeakPolarHBondContact CB-O 3.47Å; H57-R163 WeakPolarHBondContact CD2-CG 2.95Å; H57-R163 PolarHBondContact CD2-O 3.11Å; H57-R163 VanDerWaalsContact CD2-O 3.29Å; H57-R163 VanDerWaalsContact NE2-CG 3.32Å; H57-R163 WeakPolarHBondContact NE2-CG 3.42Å
58	S	97.2	Very high	96.9	Very high	8 Å²	8	36.4 Å²	36.4	6%	0.056	20%	0.197	C	C	.	.	H	α-helix	trans	-67.4	-42.8	173.5	-72.9	0	0	0	0	111.6	V52 D53 S55 R60 A61 F62 Y121	V52-S58 WeakPolarHBondContact CA-OG 3.27Å; D53-S58 PolarHBondContact N-OG 3.39Å; D53-S58 PolarHBondContact OD1-OG 2.89Å; S55-S58 PolarHBondContact O-N 3Å; S55-S58 VanDerWaalsContact O-N 3.11Å; S55-S58 PolarHBondContact OG-N 2.74Å; S58-R60 VanDerWaalsContact C-N 3.3Å; S58-R60 PolarHBondContact O-N 2.91Å; S58-A61 PolarHBondContact O-N 3.11Å; S58-F62 PolarHBondContact O-N 3.34Å; S58-F62 VanDerWaalsContact O-N 3.1Å; S58-Y121 WeakPolarHBondContact CB-OH 3.43Å
59	A	97.4	Very high	96.7	Very high	39 Å²	39	38.5 Å²	38.5	32%	0.322	21%	0.208	S	C	.	.	H	α-helix	trans	-59.4	-42.3	175.1	0	0	0	0	0	112	S55 D56 F62 Q63 Y121	S55-A59 PolarHBondContact O-N 3.44Å; D56-A59 PolarHBondContact O-N 2.76Å; A59-F62 PolarHBondContact O-N 3.45Å; A59-Q63 PolarHBondContact O-N 3.28Å; A59-Y121 WeakPolarHBondContact CA-OH 3.36Å; A59-Y121 PolarHBondContact N-OH 3.49Å; A59-Y121 VanDerWaalsContact N-OH 3.1Å
60	R	96.5	Very high	96.3	Very high	63 Å²	63	44.5 Å²	44.5	24%	0.238	23%	0.231	C	C	.	.	H	α-helix	trans	-72.6	-34.1	178.8	-165.1	-176.3	64.1	75.3	19.1	113	D56 H57 S58 F62 Q63 W64 I191 P192	D56-R60 VanDerWaalsContact O-CB 3.23Å; D56-R60 WeakPolarHBondContact O-CB 3.39Å; D56-R60 PolarHBondContact O-N 3.22Å; H57-R60 PolarHBondContact O-N 3.07Å; S58-R60 VanDerWaalsContact C-N 3.3Å; S58-R60 PolarHBondContact O-N 2.91Å; R60-F62 VanDerWaalsContact C-N 3.31Å; R60-Q63 PolarHBondContact O-N 2.99Å; R60-W64 WeakPolarHBondContact O-CB 3.28Å; R60-W64 PolarHBondContact O-N 2.81Å; R60-I191 PolarHBondContact NH2-O 2.84Å; R60-P192 PolarHBondContact NH1-O 3.35Å; R60-P192 PolarHBondContact NH2-O 2.83Å
61	A	98.2	Very high	95.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-42.6	173.3	0	0	0	0	0	111.1	L50 H57 S58 W64 Y65 I159 I191	L50-A61 HydrophobicContact CD2-CB 4.35Å; H57-A61 WeakPolarHBondContact O-CB 3.42Å; H57-A61 PolarHBondContact O-N 3.09Å; S58-A61 PolarHBondContact O-N 3.11Å; A61-W64 PolarHBondContact O-N 3.42Å; A61-Y65 PolarHBondContact O-N 2.95Å; A61-Y65 VanDerWaalsContact O-N 3.14Å; A61-I159 HydrophobicContact CB-CG2 4.32Å; A61-I191 HydrophobicContact CB-CB 4.34Å; A61-I191 HydrophobicContact CB-CG1 3.98Å
62	F	98.4	Very high	95.2	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-42.5	173	178.6	-142.1	0	0	0	112.3	L50 S58 A59 R60 W64 Y65 L66 L76 F78 Y121 K124 A125	L50-F62 HydrophobicContact CD1-CD2 4.18Å; L50-F62 HydrophobicContact CD2-CB 4.34Å; S58-F62 PolarHBondContact O-N 3.34Å; S58-F62 VanDerWaalsContact O-N 3.1Å; A59-F62 PolarHBondContact O-N 3.45Å; R60-F62 VanDerWaalsContact C-N 3.31Å; F62-W64 VanDerWaalsContact C-N 3.33Å; F62-W64 PolarHBondContact O-N 3.32Å; F62-Y65 HydrophobicContact CD2-CD1 4.05Å; F62-Y65 HydrophobicContact CE2-CD1 4.01Å; F62-Y65 WeakPolarHBondContact O-CB 3.45Å; F62-Y65 PolarHBondContact O-N 3.02Å; F62-L66 HydrophobicContact CD1-CD1 4.49Å; F62-L66 HydrophobicContact CD2-CD1 4.45Å; F62-L66 HydrophobicContact CD2-CG 4.16Å; F62-L66 HydrophobicContact CE1-CD1 4.13Å; F62-L66 HydrophobicContact CE2-CD1 4.03Å; F62-L66 HydrophobicContact CE2-CD2 3.68Å; F62-L66 HydrophobicContact CE2-CG 3.74Å; F62-L66 HydrophobicContact CZ-CD1 3.86Å; F62-L66 HydrophobicContact CZ-CD2 3.92Å; F62-L66 HydrophobicContact CZ-CG 4.05Å; F62-L66 WeakPolarHBondContact O-CG 3.44Å; F62-L66 PolarHBondContact O-N 3.3Å; F62-L66 VanDerWaalsContact O-N 3.09Å; F62-L76 HydrophobicContact CD2-CD2 4.02Å; F62-L76 HydrophobicContact CE2-CD2 3.54Å; F62-F78 HydrophobicContact CB-CE1 4.48Å; F62-F78 HydrophobicContact CD1-CE1 4.25Å; F62-F78 HydrophobicContact CD1-CZ 4.24Å; F62-F78 AromaticContact CD2-CE1 3.89Å; F62-F78 HydrophobicContact CD2-CE1 3.89Å; F62-F78 AromaticContact CD2-CZ 3.87Å; F62-F78 HydrophobicContact CD2-CZ 3.87Å; F62-F78 HydrophobicContact CE1-CE1 4.45Å; F62-F78 AromaticContact CE1-CZ 3.98Å; F62-F78 HydrophobicContact CE1-CZ 3.98Å; F62-F78 HydrophobicContact CE2-CE1 4.17Å; F62-F78 AromaticContact CE2-CZ 3.66Å; F62-F78 HydrophobicContact CE2-CZ 3.66Å; F62-F78 AromaticContact CG-CE1 3.96Å; F62-F78 HydrophobicContact CG-CE1 3.96Å; F62-F78 HydrophobicContact CG-CZ 4.18Å; F62-F78 HydrophobicContact CZ-CE1 4.44Å; F62-F78 AromaticContact CZ-CZ 3.72Å; F62-F78 HydrophobicContact CZ-CZ 3.72Å; F62-Y121 HydrophobicContact CB-CD1 4.29Å; F62-Y121 HydrophobicContact CB-CE1 3.97Å; F62-Y121 AromaticContact CD1-CD1 3.5Å; F62-Y121 HydrophobicContact CD1-CD1 3.5Å; F62-Y121 AromaticContact CD1-CE1 3.84Å; F62-Y121 HydrophobicContact CD1-CE1 3.84Å; F62-Y121 HydrophobicContact CE1-CD1 4.09Å; F62-Y121 HydrophobicContact CG-CD1 4.11Å; F62-Y121 HydrophobicContact CG-CE1 4.27Å; F62-K124 HydrophobicContact CD1-CD 4.07Å; F62-K124 HydrophobicContact CE1-CB 3.92Å; F62-K124 HydrophobicContact CE1-CD 3.66Å; F62-K124 HydrophobicContact CE1-CG 3.66Å; F62-K124 HydrophobicContact CZ-CG 4.34Å; F62-A125 HydrophobicContact CZ-CB 3.89Å
63	Q	98	Very high	94.8	Very high	57 Å²	57	51.6 Å²	51.6	27%	0.266	27%	0.268	S	S	.	.	H	α-helix	trans	-59.8	-44	176.2	-170.4	58.2	50.7	0	0	111.8	A59 R60 Y65 L66 D67	A59-Q63 PolarHBondContact O-N 3.28Å; R60-Q63 PolarHBondContact O-N 2.99Å; Q63-Y65 VanDerWaalsContact C-N 3.3Å; Q63-Y65 PolarHBondContact O-N 2.84Å; Q63-L66 WeakPolarHBondContact O-CB 3.25Å; Q63-L66 PolarHBondContact O-N 2.92Å; Q63-L66 VanDerWaalsContact O-N 3.11Å; Q63-D67 WeakPolarHBondContact CG-OD2 3.4Å; Q63-D67 VanDerWaalsContact NE2-CG 3.35Å; Q63-D67 PolarHBondContact NE2-OD1 3.26Å; Q63-D67 PolarHBondContact NE2-OD2 3.28Å; Q63-D67 PolarHBondContact O-N 3.43Å
64	W	97.9	Very high	94.8	Very high	80 Å²	80	50.2 Å²	50.2	30%	0.303	26%	0.261	S	S	.	.	H	α-helix	trans	-59.4	-41	176.5	-176.4	89.9	0	0	0	112.2	R60 A61 F62 D67 N68 L69 I159 V189 I191	R60-W64 WeakPolarHBondContact O-CB 3.28Å; R60-W64 PolarHBondContact O-N 2.81Å; A61-W64 PolarHBondContact O-N 3.42Å; F62-W64 VanDerWaalsContact C-N 3.33Å; F62-W64 PolarHBondContact O-N 3.32Å; W64-D67 PolarHBondContact O-N 3.36Å; W64-N68 VanDerWaalsContact CD1-ND2 3.31Å; W64-N68 HydrophobicContact CD2-CB 4.17Å; W64-N68 HydrophobicContact CH2-CB 4.25Å; W64-N68 HydrophobicContact CZ2-CB 3.87Å; W64-N68 PolarHBondContact NE1-ND2 3.35Å; W64-N68 VanDerWaalsContact O-CB 3.32Å; W64-N68 WeakPolarHBondContact O-CB 3.47Å; W64-N68 PolarHBondContact O-N 2.9Å; W64-N68 PolarHBondContact O-ND2 3.38Å; W64-L69 HydrophobicContact CZ3-CB 4.12Å; W64-L69 HydrophobicContact CZ3-CD2 4.37Å; W64-I159 HydrophobicContact CE3-CG2 4.41Å; W64-I159 HydrophobicContact CZ3-CD1 4.48Å; W64-V189 HydrophobicContact CH2-CG1 3.99Å; W64-V189 HydrophobicContact CZ3-CG1 4.06Å; W64-I191 HydrophobicContact CB-CD1 4.36Å; W64-I191 HydrophobicContact CB-CG1 4.24Å; W64-I191 HydrophobicContact CB-CG2 3.82Å; W64-I191 HydrophobicContact CD2-CD1 3.48Å; W64-I191 VanDerWaalsContact CD2-CD1 3.48Å; W64-I191 HydrophobicContact CD2-CG1 4.31Å; W64-I191 HydrophobicContact CE3-CD1 3.47Å; W64-I191 VanDerWaalsContact CE3-CD1 3.47Å; W64-I191 HydrophobicContact CE3-CG1 4.33Å; W64-I191 HydrophobicContact CG-CD1 3.87Å; W64-I191 HydrophobicContact CG-CG1 4.27Å; W64-I191 HydrophobicContact CG-CG2 3.89Å; W64-I191 HydrophobicContact CZ3-CD1 4.02Å
65	Y	97.9	Very high	94.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-47.7	173.8	163.4	-99.4	0	0	0	111.9	V48 L50 A61 F62 Q63 D67 N68 L69 R70 D74 L76 I130 I159	V48-Y65 HydrophobicContact CB-CE2 4.38Å; V48-Y65 HydrophobicContact CG1-CD2 3.96Å; V48-Y65 HydrophobicContact CG1-CE2 4.05Å; V48-Y65 HydrophobicContact CG2-CD2 4.48Å; V48-Y65 HydrophobicContact CG2-CE2 3.82Å; L50-Y65 HydrophobicContact CD1-CG 4.45Å; A61-Y65 PolarHBondContact O-N 2.95Å; A61-Y65 VanDerWaalsContact O-N 3.14Å; F62-Y65 HydrophobicContact CD2-CD1 4.05Å; F62-Y65 HydrophobicContact CE2-CD1 4.01Å; F62-Y65 WeakPolarHBondContact O-CB 3.45Å; F62-Y65 PolarHBondContact O-N 3.02Å; Q63-Y65 VanDerWaalsContact C-N 3.3Å; Q63-Y65 PolarHBondContact O-N 2.84Å; Y65-D67 VanDerWaalsContact C-N 3.25Å; Y65-D67 PolarHBondContact O-N 3.03Å; Y65-N68 PolarHBondContact O-N 3.45Å; Y65-L69 HydrophobicContact CD2-CB 3.95Å; Y65-L69 HydrophobicContact CD2-CD2 4.33Å; Y65-L69 HydrophobicContact CD2-CG 4.48Å; Y65-L69 HydrophobicContact CE2-CB 4.36Å; Y65-L69 PolarHBondContact O-N 2.86Å; Y65-R70 HydrophobicContact CE1-CB 4.28Å; Y65-R70 HydrophobicContact CE1-CG 4.49Å; Y65-R70 HydrophobicContact CE2-CB 4.44Å; Y65-R70 PolarHBondContact O-N 3.18Å; Y65-D74 WeakPolarHBondContact CE2-OD2 3.45Å; Y65-D74 WeakPolarHBondContact OH-CB 3.45Å; Y65-D74 PolarHBondContact OH-OD2 2.89Å; Y65-L76 HydrophobicContact CD1-CD1 4.21Å; Y65-L76 HydrophobicContact CD1-CD2 3.69Å; Y65-L76 HydrophobicContact CD1-CG 4.5Å; Y65-L76 HydrophobicContact CE1-CD1 3.36Å; Y65-L76 HydrophobicContact CE1-CD2 3.42Å; Y65-L76 VanDerWaalsContact CE1-CD2 3.42Å; Y65-L76 HydrophobicContact CE1-CG 3.99Å; Y65-L76 HydrophobicContact CE2-CD1 3.95Å; Y65-L76 WeakPolarHBondContact OH-CD1 3.48Å; Y65-I130 HydrophobicContact CE1-CD1 3.82Å; Y65-I159 HydrophobicContact CD2-CD1 3.57Å; Y65-I159 HydrophobicContact CG-CD1 4.01Å
66	L	96.9	Very high	95.1	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-58	-41	179	-66.8	173.6	0	0	0	111.8	F62 Q63 F128 I130	F62-L66 HydrophobicContact CD1-CD1 4.49Å; F62-L66 HydrophobicContact CD2-CD1 4.45Å; F62-L66 HydrophobicContact CD2-CG 4.16Å; F62-L66 HydrophobicContact CE1-CD1 4.13Å; F62-L66 HydrophobicContact CE2-CD1 4.03Å; F62-L66 HydrophobicContact CE2-CD2 3.68Å; F62-L66 HydrophobicContact CE2-CG 3.74Å; F62-L66 HydrophobicContact CZ-CD1 3.86Å; F62-L66 HydrophobicContact CZ-CD2 3.92Å; F62-L66 HydrophobicContact CZ-CG 4.05Å; F62-L66 WeakPolarHBondContact O-CG 3.44Å; F62-L66 PolarHBondContact O-N 3.3Å; F62-L66 VanDerWaalsContact O-N 3.09Å; Q63-L66 WeakPolarHBondContact O-CB 3.25Å; Q63-L66 PolarHBondContact O-N 2.92Å; Q63-L66 VanDerWaalsContact O-N 3.11Å; L66-F128 HydrophobicContact CD1-CD2 3.88Å; L66-F128 HydrophobicContact CD1-CE2 3.7Å; L66-F128 HydrophobicContact CD1-CZ 4.15Å; L66-F128 HydrophobicContact CD2-CB 4.13Å; L66-F128 HydrophobicContact CD2-CD1 4.45Å; L66-F128 HydrophobicContact CD2-CD2 3.98Å; L66-F128 HydrophobicContact CD2-CG 3.94Å; L66-I130 HydrophobicContact CD2-CD1 3.38Å
67	D	95.7	Very high	95.3	Very high	106 Å²	106	41.8 Å²	41.8	57%	0.567	21%	0.205	S	C	*	.	H	α-helix	trans	-82.3	-26.8	-173.5	-59.9	-21.5	0	0	0	113	Q63 W64 Y65	Q63-D67 WeakPolarHBondContact CG-OD2 3.4Å; Q63-D67 VanDerWaalsContact NE2-CG 3.35Å; Q63-D67 PolarHBondContact NE2-OD1 3.26Å; Q63-D67 PolarHBondContact NE2-OD2 3.28Å; Q63-D67 PolarHBondContact O-N 3.43Å; W64-D67 PolarHBondContact O-N 3.36Å; Y65-D67 VanDerWaalsContact C-N 3.25Å; Y65-D67 PolarHBondContact O-N 3.03Å
68	N	95.2	Very high	95.5	Very high	102 Å²	102	39.9 Å²	39.9	55%	0.545	20%	0.196	S	C	.	.	H	α-helix	trans	-126.7	-25.7	-165.3	-60.6	-91.1	0	0	0	116	W64 Y65	W64-N68 VanDerWaalsContact CD1-ND2 3.31Å; W64-N68 HydrophobicContact CD2-CB 4.17Å; W64-N68 HydrophobicContact CH2-CB 4.25Å; W64-N68 HydrophobicContact CZ2-CB 3.87Å; W64-N68 PolarHBondContact NE1-ND2 3.35Å; W64-N68 VanDerWaalsContact O-CB 3.32Å; W64-N68 WeakPolarHBondContact O-CB 3.47Å; W64-N68 PolarHBondContact O-N 2.9Å; W64-N68 PolarHBondContact O-ND2 3.38Å; Y65-N68 PolarHBondContact O-N 3.45Å
69	L	93.8	Very high	95.5	Very high	43 Å²	43	39.6 Å²	39.6	23%	0.225	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.6	-12.4	-168.6	-165.5	70.1	0	0	0	114.6	K46 W64 Y65 G71 I157 I159	K46-L69 PolarHBondContact NZ-O 2.93Å; W64-L69 HydrophobicContact CZ3-CB 4.12Å; W64-L69 HydrophobicContact CZ3-CD2 4.37Å; Y65-L69 HydrophobicContact CD2-CB 3.95Å; Y65-L69 HydrophobicContact CD2-CD2 4.33Å; Y65-L69 HydrophobicContact CD2-CG 4.48Å; Y65-L69 HydrophobicContact CE2-CB 4.36Å; Y65-L69 PolarHBondContact O-N 2.86Å; L69-G71 PolarHBondContact O-N 2.98Å; L69-I157 HydrophobicContact CD2-CD1 3.61Å; L69-I157 HydrophobicContact CD2-CG2 4.25Å; L69-I159 HydrophobicContact CD2-CD1 3.73Å
70	R	91.2	Very high	95.6	Very high	126 Å²	126	39.9 Å²	39.9	48%	0.475	19%	0.187	S	C	.	.			trans	-51.3	119.6	-177.1	-180	179.3	66.2	144	-0.5	112.6	Y65 F128 I130	Y65-R70 HydrophobicContact CE1-CB 4.28Å; Y65-R70 HydrophobicContact CE1-CG 4.49Å; Y65-R70 HydrophobicContact CE2-CB 4.44Å; Y65-R70 PolarHBondContact O-N 3.18Å; R70-F128 PolarHBondContact NH1-O 3.14Å; R70-I130 VanDerWaalsContact CD-CD1 3.43Å; R70-I130 HydrophobicContact CG-CD1 3.87Å; R70-I130 HydrophobicContact CG-CG1 4.36Å
71	G	88.4	Confident	95.5	Very high	18 Å²	18	37.7 Å²	37.7	19%	0.186	18%	0.18	C	C	.	.			trans	-100.8	154.2	168.1	0	0	0	0	0	112.7	L69 N73 D74	L69-G71 PolarHBondContact O-N 2.98Å; G71-N73 PolarHBondContact O-N 2.86Å; G71-D74 WeakPolarHBondContact CA-OD1 3.45Å; G71-D74 VanDerWaalsContact N-CG 3.32Å; G71-D74 PolarHBondContact N-OD2 3.41Å; G71-D74 PolarHBondContact O-N 3.33Å
72	K	84.8	Confident	95.2	Very high	86 Å²	86	38.3 Å²	38.3	37%	0.374	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-43.6	177.3	167.3	-174.5	-154	156	0	112.6	G14 S15	G14-K72 VanDerWaalsContact C-CD 3.41Å; G14-K72 WeakPolarHBondContact O-CB 3.17Å; G14-K72 WeakPolarHBondContact O-CG 3.13Å; S15-K72 VanDerWaalsContact N-CD 3.33Å; S15-K72 PolarHBondContact OG-NZ 2.78Å
73	N	91.1	Very high	94.7	Very high	61 Å²	61	44.5 Å²	44.5	33%	0.326	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	11	-168.9	-67.9	-27	0	0	0	112.2	E43 K45 G71	E43-N73 PolarHBondContact O-ND2 3.42Å; K45-N73 HydrophobicContact CB-CB 4.07Å; K45-N73 VanDerWaalsContact CG-O 3.32Å; K45-N73 WeakPolarHBondContact CG-O 3.32Å; G71-N73 PolarHBondContact O-N 2.86Å
74	D	94.8	Very high	93.7	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.011	21%	0.206	C	C	.	.			trans	-62.3	143.9	-178.5	-72.2	2.8	0	0	0	111	K46 V48 Y65 G71 L76	K46-D74 WeakPolarHBondContact CE-OD1 3.44Å; K46-D74 IonicContact NZ-OD1 3.08Å; K46-D74 IonicContact NZ-OD2 3.84Å; K46-D74 WeakPolarHBondContact O-CA 3.16Å; V48-D74 HydrophobicContact CG2-CB 4.35Å; Y65-D74 WeakPolarHBondContact CE2-OD2 3.45Å; Y65-D74 WeakPolarHBondContact OH-CB 3.45Å; Y65-D74 PolarHBondContact OH-OD2 2.89Å; G71-D74 WeakPolarHBondContact CA-OD1 3.45Å; G71-D74 VanDerWaalsContact N-CG 3.32Å; G71-D74 PolarHBondContact N-OD2 3.41Å; G71-D74 PolarHBondContact O-N 3.33Å; D74-L76 HydrophobicContact CB-CD1 4.28Å
75	E	96.2	Very high	92.2	Very high	30 Å²	30	42.8 Å²	42.8	14%	0.14	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	115.9	169.6	-171.5	174	163.9	0	0	109.2	K45 K46 V47 V48 H77 S131 Q133	K45-E75 WeakPolarHBondContact CE-OE2 3.45Å; K45-E75 IonicContact NZ-OE2 2.79Å; K45-E75 PolarHBondContact NZ-OE2 3.37Å; K46-E75 PolarHBondContact O-N 3.38Å; V47-E75 WeakPolarHBondContact CA-O 3.06Å; V48-E75 PolarHBondContact N-O 3.1Å; E75-H77 IonicContact OE1-CD2 2.66Å; E75-H77 IonicContact OE1-NE2 3.96Å; E75-H77 PolarHBondContact OE1-NE2 3.12Å; E75-H77 VanDerWaalsContact OE1-NE2 3.08Å; E75-S131 WeakPolarHBondContact CA-O 3.42Å; E75-Q133 PolarHBondContact OE1-NE2 3.14Å
76	L	98.1	Very high	90.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124	-177.1	-107	67.6	0	0	0	111.8	V48 L50 F62 Y65 D74 F78 I130 S131 C132 Q133	V48-L76 HydrophobicContact CB-CD1 3.55Å; V48-L76 HydrophobicContact CB-CG 4.12Å; V48-L76 HydrophobicContact CG1-CD1 4.02Å; V48-L76 HydrophobicContact CG1-CG 4.32Å; V48-L76 HydrophobicContact CG2-CD1 3.93Å; V48-L76 WeakPolarHBondContact O-CA 3.34Å; L50-L76 HydrophobicContact CD1-CD2 3.71Å; L50-L76 HydrophobicContact CD1-CG 3.98Å; F62-L76 HydrophobicContact CD2-CD2 4.02Å; F62-L76 HydrophobicContact CE2-CD2 3.54Å; Y65-L76 HydrophobicContact CD1-CD1 4.21Å; Y65-L76 HydrophobicContact CD1-CD2 3.69Å; Y65-L76 HydrophobicContact CD1-CG 4.5Å; Y65-L76 HydrophobicContact CE1-CD1 3.36Å; Y65-L76 HydrophobicContact CE1-CD2 3.42Å; Y65-L76 VanDerWaalsContact CE1-CD2 3.42Å; Y65-L76 HydrophobicContact CE1-CG 3.99Å; Y65-L76 HydrophobicContact CE2-CD1 3.95Å; Y65-L76 WeakPolarHBondContact OH-CD1 3.48Å; D74-L76 HydrophobicContact CB-CD1 4.28Å; L76-F78 HydrophobicContact CB-CE2 4.35Å; L76-F78 HydrophobicContact CD2-CE1 4.33Å; L76-F78 HydrophobicContact CD2-CE2 4.27Å; L76-F78 HydrophobicContact CD2-CZ 3.74Å; L76-I130 HydrophobicContact CB-CG2 4.3Å; L76-I130 HydrophobicContact CD1-CG2 3.87Å; L76-I130 HydrophobicContact CD2-CG2 4.37Å; L76-I130 HydrophobicContact CG-CG2 4.4Å; L76-S131 PolarHBondContact N-O 3.45Å; L76-C132 HydrophobicContact CB-CB 3.88Å; L76-C132 CarbonylContact O-C 3.58Å; L76-C132 WeakPolarHBondContact O-CA 3.48Å; L76-C132 WeakPolarHBondContact O-CB 3.07Å; L76-Q133 PolarHBondContact O-N 2.82Å
77	H	98.5	Very high	88.6	Confident	5 Å²	5	50.6 Å²	50.6	2%	0.023	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	103.5	175	-69.6	-172.8	0	0	0	109.4	V48 F49 L50 E75 F135 Q153	V48-H77 PolarHBondContact O-N 3.36Å; F49-H77 HydrophobicContact CD2-CB 4.15Å; L50-H77 PolarHBondContact N-O 3.29Å; E75-H77 IonicContact OE1-CD2 2.66Å; E75-H77 IonicContact OE1-NE2 3.96Å; E75-H77 PolarHBondContact OE1-NE2 3.12Å; E75-H77 VanDerWaalsContact OE1-NE2 3.08Å; H77-F135 HydrophobicContact CB-CD2 4.39Å; H77-F135 HydrophobicContact CB-CE2 3.97Å; H77-F135 AromaticContact CG-CE2 3.75Å; H77-F135 AromaticContact ND1-CE2 3.89Å; H77-Q153 PolarHBondContact CE1-OE1 2.73Å; H77-Q153 VanDerWaalsContact CE1-OE1 3.3Å
78	F	98.7	Very high	86.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	128.5	172	-63.8	-72.9	0	0	0	110.1	L50 V52 F62 L76 L118 Y121 L122 A125 C132 Q133 A134 F135	L50-F78 HydrophobicContact CB-CD1 3.87Å; L50-F78 HydrophobicContact CB-CE1 4.14Å; L50-F78 HydrophobicContact CD1-CE1 4.12Å; L50-F78 WeakPolarHBondContact O-CA 3.42Å; V52-F78 HydrophobicContact CG1-CD1 3.96Å; V52-F78 HydrophobicContact CG2-CB 4.38Å; F62-F78 HydrophobicContact CB-CE1 4.48Å; F62-F78 HydrophobicContact CD1-CE1 4.25Å; F62-F78 HydrophobicContact CD1-CZ 4.24Å; F62-F78 AromaticContact CD2-CE1 3.89Å; F62-F78 HydrophobicContact CD2-CE1 3.89Å; F62-F78 AromaticContact CD2-CZ 3.87Å; F62-F78 HydrophobicContact CD2-CZ 3.87Å; F62-F78 HydrophobicContact CE1-CE1 4.45Å; F62-F78 AromaticContact CE1-CZ 3.98Å; F62-F78 HydrophobicContact CE1-CZ 3.98Å; F62-F78 HydrophobicContact CE2-CE1 4.17Å; F62-F78 AromaticContact CE2-CZ 3.66Å; F62-F78 HydrophobicContact CE2-CZ 3.66Å; F62-F78 AromaticContact CG-CE1 3.96Å; F62-F78 HydrophobicContact CG-CE1 3.96Å; F62-F78 HydrophobicContact CG-CZ 4.18Å; F62-F78 HydrophobicContact CZ-CE1 4.44Å; F62-F78 AromaticContact CZ-CZ 3.72Å; F62-F78 HydrophobicContact CZ-CZ 3.72Å; L76-F78 HydrophobicContact CB-CE2 4.35Å; L76-F78 HydrophobicContact CD2-CE1 4.33Å; L76-F78 HydrophobicContact CD2-CE2 4.27Å; L76-F78 HydrophobicContact CD2-CZ 3.74Å; F78-L118 HydrophobicContact CB-CD2 3.7Å; F78-Y121 HydrophobicContact CD1-CD1 4.06Å; F78-Y121 HydrophobicContact CD1-CG 4.07Å; F78-Y121 AromaticContact CE1-CD1 3.68Å; F78-Y121 HydrophobicContact CE1-CD1 3.68Å; F78-Y121 HydrophobicContact CE1-CG 4.07Å; F78-Y121 HydrophobicContact CG-CG 4.5Å; F78-Y121 HydrophobicContact CZ-CD1 4.21Å; F78-Y121 HydrophobicContact CZ-CG 4.49Å; F78-L122 HydrophobicContact CD2-CD2 4.32Å; F78-A125 HydrophobicContact CE2-CB 3.92Å; F78-A125 HydrophobicContact CZ-CB 4.21Å; F78-C132 HydrophobicContact CD2-CB 4.42Å; F78-C132 HydrophobicContact CE2-CB 4.07Å; F78-Q133 PolarHBondContact N-O 3.37Å; F78-A134 CarbonylContact O-C 3.57Å; F78-A134 VanDerWaalsContact O-CA 3.31Å; F78-A134 WeakPolarHBondContact O-CA 3.3Å; F78-F135 PolarHBondContact O-N 2.9Å
79	V	98.5	Very high	84.7	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.9	-175.5	-172.1	0	0	0	0	110.9	F49 L50 P51 V52 F135 L146 F149	F49-V79 HydrophobicContact CD2-CG2 4.15Å; F49-V79 HydrophobicContact CE1-CB 4.41Å; F49-V79 HydrophobicContact CE1-CG2 4.11Å; F49-V79 HydrophobicContact CE2-CG2 3.5Å; F49-V79 VanDerWaalsContact CE2-CG2 3.5Å; F49-V79 HydrophobicContact CZ-CB 4.06Å; F49-V79 HydrophobicContact CZ-CG1 4.29Å; F49-V79 HydrophobicContact CZ-CG2 3.49Å; F49-V79 VanDerWaalsContact CZ-CG2 3.49Å; L50-V79 PolarHBondContact O-N 3.17Å; P51-V79 WeakPolarHBondContact CA-O 3.39Å; V52-V79 PolarHBondContact N-O 3.28Å; V79-F135 WeakPolarHBondContact CA-O 3.32Å; V79-F135 HydrophobicContact CG2-CB 4.38Å; V79-F135 HydrophobicContact CG2-CD2 4.24Å; V79-L146 HydrophobicContact CB-CD2 4.11Å; V79-L146 HydrophobicContact CG1-CD2 3.8Å; V79-F149 HydrophobicContact CG1-CD1 3.92Å; V79-F149 HydrophobicContact CG1-CE1 4.27Å; V79-F149 HydrophobicContact CG2-CD1 3.85Å; V79-F149 HydrophobicContact CG2-CE1 3.74Å
80	Y	97.8	Very high	82.9	Confident	45 Å²	45	52.7 Å²	52.7	18%	0.176	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.2	173.2	-168.4	-83.5	0	0	0	110	V52 D53 I82 A114 L117 F135 V136 H137	V52-Y80 WeakPolarHBondContact O-CD2 3.48Å; D53-Y80 HydrophobicContact CB-CD2 4.49Å; D53-Y80 HydrophobicContact CB-CE2 3.96Å; Y80-I82 HydrophobicContact CD1-CG1 3.88Å; Y80-I82 HydrophobicContact CE1-CG1 3.68Å; Y80-A114 HydrophobicContact CD1-CB 3.55Å; Y80-A114 HydrophobicContact CE1-CB 3.8Å; Y80-A114 HydrophobicContact CG-CB 4.08Å; Y80-L117 HydrophobicContact CD2-CD2 3.51Å; Y80-L117 HydrophobicContact CE2-CD2 3.48Å; Y80-L117 VanDerWaalsContact CE2-CD2 3.48Å; Y80-F135 PolarHBondContact N-O 3.24Å; Y80-V136 WeakPolarHBondContact O-CA 3.46Å; Y80-H137 PolarHBondContact O-N 3.2Å
81	V	95.8	Very high	81.1	Confident	17 Å²	17	48 Å²	48	10%	0.103	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	114.7	176.9	-171.9	0	0	0	0	109.8	K83 H137 A140 P142 T145 L146	V81-K83 PolarHBondContact O-N 3.43Å; V81-H137 CarbonylContact C-O 3.57Å; V81-H137 WeakPolarHBondContact CA-O 3.41Å; V81-H137 HydrophobicContact CG1-CB 4.22Å; V81-H137 HydrophobicContact CG2-CB 4.28Å; V81-A140 HydrophobicContact CG1-CB 3.92Å; V81-A140 WeakPolarHBondContact CG1-O 3.49Å; V81-P142 HydrophobicContact CB-CB 4.12Å; V81-P142 HydrophobicContact CB-CG 4.19Å; V81-P142 HydrophobicContact CG1-CB 4.3Å; V81-P142 HydrophobicContact CG1-CG 4.09Å; V81-P142 HydrophobicContact CG2-CB 4.5Å; V81-T145 HydrophobicContact CG1-CG2 4.41Å; V81-T145 HydrophobicContact CG2-CG2 3.93Å; V81-L146 HydrophobicContact CG2-CD2 3.95Å; V81-L146 HydrophobicContact CG2-CG 4.21Å
82	I	91.6	Very high	79.7	Confident	14 Å²	14	55.1 Å²	55.1	7%	0.072	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-79.5	116.2	169.8	-58	171.4	0	0	0	107.1	Y80 N110 I111 A114 V136 H137 V138 N139 A140	Y80-I82 HydrophobicContact CD1-CG1 3.88Å; Y80-I82 HydrophobicContact CE1-CG1 3.68Å; I82-N110 HydrophobicContact CD1-CB 4.37Å; I82-N110 HydrophobicContact CG2-CB 4.17Å; I82-I111 HydrophobicContact CD1-CB 4.29Å; I82-I111 HydrophobicContact CD1-CG1 3.65Å; I82-A114 HydrophobicContact CD1-CB 4.05Å; I82-A114 HydrophobicContact CG1-CB 4.26Å; I82-V136 HydrophobicContact CD1-CG1 3.89Å; I82-V136 HydrophobicContact CG1-CG1 4.27Å; I82-H137 PolarHBondContact N-O 3.1Å; I82-V138 HydrophobicContact CD1-CG2 4.24Å; I82-N139 WeakPolarHBondContact O-CA 3.36Å; I82-N139 PolarHBondContact O-N 3.09Å; I82-A140 PolarHBondContact O-N 3.38Å
83	K	88.4	Confident	78.5	Confident	130 Å²	130	57.5 Å²	57.5	57%	0.565	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-63.8	155.3	178.3	-66	175.7	-175.6	169.4	0	110.3	V81 I85 P142	V81-K83 PolarHBondContact O-N 3.43Å; K83-I85 PolarHBondContact O-N 3.14Å; K83-P142 HydrophobicContact CD-CG 4.38Å; K83-P142 HydrophobicContact CG-CG 3.7Å
84	P	75.6	Confident	77	Confident	27 Å²	27	56.5 Å²	56.5	18%	0.175	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-56.9	133.5	168.3	-20.5	32.6	0	0	0	110.4	F86 T87 N139 A140	P84-F86 PolarHBondContact O-N 3.46Å; P84-T87 HydrophobicContact CB-CG2 3.76Å; P84-T87 HydrophobicContact CG-CG2 3.95Å; P84-N139 WeakPolarHBondContact CA-OD1 3.38Å; P84-N139 WeakPolarHBondContact CB-OD1 3.38Å; P84-A140 WeakPolarHBondContact CD-O 3.41Å
85	I	68	Low	75.3	Confident	73 Å²	73	60 Å²	60	37%	0.374	32%	0.323	S	S	.	.	S	Bend	trans	-60.8	-26.7	169.6	-56.8	176.5	0	0	0	108.9	K83 I103 T107	K83-I85 PolarHBondContact O-N 3.14Å; I85-I103 HydrophobicContact CD1-CG2 4.38Å; I85-T107 WeakPolarHBondContact CD1-OG1 3.33Å
86	F	64.1	Low	73.7	Confident	74 Å²	74	62.9 Å²	62.9	33%	0.325	35%	0.351	S	S	.	.			trans	-123.5	106.3	-172.6	-56.8	-52.3	0	0	0	114	P84 I91 M95 I103	P84-F86 PolarHBondContact O-N 3.46Å; F86-I91 HydrophobicContact CB-CD1 3.68Å; F86-I91 HydrophobicContact CB-CG2 3.82Å; F86-I91 HydrophobicContact CD1-CB 4.44Å; F86-I91 HydrophobicContact CD1-CD1 4.18Å; F86-I91 HydrophobicContact CD1-CG1 4.24Å; F86-I91 HydrophobicContact CD1-CG2 3.44Å; F86-I91 VanDerWaalsContact CD1-CG2 3.44Å; F86-I91 HydrophobicContact CE1-CG2 4.35Å; F86-I91 HydrophobicContact CG-CD1 4.42Å; F86-I91 HydrophobicContact CG-CG2 3.81Å; F86-M95 HydrophobicContact CD1-CG 4.28Å; F86-M95 HydrophobicContact CD1-SD 3.79Å; F86-M95 HydrophobicContact CD2-SD 3.99Å; F86-M95 HydrophobicContact CE1-CG 4.15Å; F86-M95 HydrophobicContact CE1-SD 3.22Å; F86-M95 WeakPolarHBondContact CE1-SD 3.34Å; F86-M95 HydrophobicContact CE2-CE 4.06Å; F86-M95 HydrophobicContact CE2-SD 3.46Å; F86-M95 WeakPolarHBondContact CE2-SD 3.4Å; F86-M95 HydrophobicContact CG-SD 4.16Å; F86-M95 HydrophobicContact CZ-CE 4.16Å; F86-M95 HydrophobicContact CZ-CG 4.48Å; F86-M95 HydrophobicContact CZ-SD 3.06Å; F86-M95 WeakPolarHBondContact CZ-SD 3.49Å; F86-I103 HydrophobicContact CE2-CD1 4.26Å; F86-I103 HydrophobicContact CE2-CG2 3.67Å; F86-I103 HydrophobicContact CZ-CB 4.44Å; F86-I103 HydrophobicContact CZ-CD1 3.68Å; F86-I103 HydrophobicContact CZ-CG1 3.89Å; F86-I103 HydrophobicContact CZ-CG2 3.72Å
87	T	55.1	Low	72.1	Confident	103 Å²	103	67.1 Å²	67.1	63%	0.632	38%	0.381	S	S	*	.			trans	-128.9	-8.7	172.9	54.4	0	0	0	0	119.8	P84	P84-T87 HydrophobicContact CB-CG2 3.76Å; P84-T87 HydrophobicContact CG-CG2 3.95Å
88	T	53.6	Low	70.4	Confident	71 Å²	71	69.2 Å²	69.2	44%	0.436	40%	0.396	S	S	.	.	S	Bend	trans	-121.4	156.1	-175.5	53.8	0	0	0	0	114.9	T90 I91	T88-T90 WeakPolarHBondContact CB-OG1 3.43Å; T88-T90 PolarHBondContact O-N 2.9Å; T88-T90 VanDerWaalsContact O-N 3.15Å; T88-T90 PolarHBondContact OG1-OG1 3.4Å; T88-I91 WeakPolarHBondContact O-CB 3.31Å; T88-I91 WeakPolarHBondContact O-CD1 3.48Å; T88-I91 WeakPolarHBondContact O-CG1 3.41Å; T88-I91 PolarHBondContact O-N 3.34Å
89	P	54.2	Low	68.9	Low	119 Å²	119	72.5 Å²	72.5	77%	0.773	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.4	178.5	-24.1	33	0	0	0	115.1	I91 E92	P89-I91 PolarHBondContact O-N 2.84Å; P89-E92 PolarHBondContact O-N 2.89Å; P89-E92 VanDerWaalsContact O-N 3.15Å
90	T	56.7	Low	67.5	Low	104 Å²	104	78.6 Å²	78.6	64%	0.638	45%	0.449	S	S	*	.	H	α-helix	trans	-53.1	-11.1	170.1	31.5	0	0	0	0	113.9	T88 A94	T88-T90 WeakPolarHBondContact CB-OG1 3.43Å; T88-T90 PolarHBondContact O-N 2.9Å; T88-T90 VanDerWaalsContact O-N 3.15Å; T88-T90 PolarHBondContact OG1-OG1 3.4Å; T90-A94 PolarHBondContact O-N 2.85Å
91	I	53.2	Low	66	Low	27 Å²	27	80.9 Å²	80.9	14%	0.138	47%	0.467	C	S	.	.	H	α-helix	trans	-81.4	-35.1	-179.8	-68.1	168.6	0	0	0	113.8	F86 T88 P89 L93 A94 M95	F86-I91 HydrophobicContact CB-CD1 3.68Å; F86-I91 HydrophobicContact CB-CG2 3.82Å; F86-I91 HydrophobicContact CD1-CB 4.44Å; F86-I91 HydrophobicContact CD1-CD1 4.18Å; F86-I91 HydrophobicContact CD1-CG1 4.24Å; F86-I91 HydrophobicContact CD1-CG2 3.44Å; F86-I91 VanDerWaalsContact CD1-CG2 3.44Å; F86-I91 HydrophobicContact CE1-CG2 4.35Å; F86-I91 HydrophobicContact CG-CD1 4.42Å; F86-I91 HydrophobicContact CG-CG2 3.81Å; T88-I91 WeakPolarHBondContact O-CB 3.31Å; T88-I91 WeakPolarHBondContact O-CD1 3.48Å; T88-I91 WeakPolarHBondContact O-CG1 3.41Å; T88-I91 PolarHBondContact O-N 3.34Å; P89-I91 PolarHBondContact O-N 2.84Å; I91-L93 PolarHBondContact O-N 2.88Å; I91-L93 VanDerWaalsContact O-N 3.17Å; I91-A94 CarbonylContact O-C 3.57Å; I91-A94 PolarHBondContact O-N 2.88Å; I91-M95 HydrophobicContact CG2-CG 3.49Å; I91-M95 VanDerWaalsContact CG2-CG 3.49Å; I91-M95 VanDerWaalsContact O-CB 3.29Å; I91-M95 WeakPolarHBondContact O-CB 3.37Å; I91-M95 VanDerWaalsContact O-CG 3.23Å; I91-M95 WeakPolarHBondContact O-CG 3.5Å; I91-M95 PolarHBondContact O-N 2.86Å
92	E	58.1	Low	64.9	Low	168 Å²	168	84.1 Å²	84.1	79%	0.785	48%	0.484	S	S	*	.	H	α-helix	trans	-54.9	-38.6	175.4	-79.2	-177.3	163.3	0	0	109.4	P89 A96	P89-E92 PolarHBondContact O-N 2.89Å; P89-E92 VanDerWaalsContact O-N 3.15Å; E92-A96 VanDerWaalsContact O-CB 3.31Å; E92-A96 WeakPolarHBondContact O-CB 3.36Å; E92-A96 PolarHBondContact O-N 2.81Å
93	L	60	Low	63.8	Low	137 Å²	137	84.7 Å²	84.7	72%	0.717	49%	0.487	S	S	*	.	H	α-helix	trans	-67.9	-45.1	172.4	-169.4	64.2	0	0	0	113.4	I91 A96 S97	I91-L93 PolarHBondContact O-N 2.88Å; I91-L93 VanDerWaalsContact O-N 3.17Å; L93-A96 PolarHBondContact O-N 2.84Å; L93-S97 PolarHBondContact O-N 3.29Å; L93-S97 PolarHBondContact O-OG 3.22Å
94	A	59.4	Low	63	Low	39 Å²	39	83.6 Å²	83.6	32%	0.322	49%	0.487	S	S	.	.	H	α-helix	trans	-68.6	-32.3	179.6	0	0	0	0	0	113.5	T90 I91 S97 S98	T90-A94 PolarHBondContact O-N 2.85Å; I91-A94 CarbonylContact O-C 3.57Å; I91-A94 PolarHBondContact O-N 2.88Å; A94-S97 WeakPolarHBondContact CA-OG 3.38Å; A94-S97 PolarHBondContact O-N 3.49Å; A94-S97 PolarHBondContact O-OG 2.95Å; A94-S97 VanDerWaalsContact O-OG 3.05Å; A94-S98 VanDerWaalsContact O-CB 3.26Å; A94-S98 WeakPolarHBondContact O-CB 3.24Å; A94-S98 PolarHBondContact O-N 3.45Å; A94-S98 PolarHBondContact O-OG 3.31Å
95	M	59.6	Low	63	Low	77 Å²	77	87.7 Å²	87.7	38%	0.379	50%	0.503	S	S	.	.	H	α-helix	trans	-72.6	-39.2	175.2	-71.7	-63.5	-68.5	0	0	111.2	F86 I91 S97 I103	F86-M95 HydrophobicContact CD1-CG 4.28Å; F86-M95 HydrophobicContact CD1-SD 3.79Å; F86-M95 HydrophobicContact CD2-SD 3.99Å; F86-M95 HydrophobicContact CE1-CG 4.15Å; F86-M95 HydrophobicContact CE1-SD 3.22Å; F86-M95 WeakPolarHBondContact CE1-SD 3.34Å; F86-M95 HydrophobicContact CE2-CE 4.06Å; F86-M95 HydrophobicContact CE2-SD 3.46Å; F86-M95 WeakPolarHBondContact CE2-SD 3.4Å; F86-M95 HydrophobicContact CG-SD 4.16Å; F86-M95 HydrophobicContact CZ-CE 4.16Å; F86-M95 HydrophobicContact CZ-CG 4.48Å; F86-M95 HydrophobicContact CZ-SD 3.06Å; F86-M95 WeakPolarHBondContact CZ-SD 3.49Å; I91-M95 HydrophobicContact CG2-CG 3.49Å; I91-M95 VanDerWaalsContact CG2-CG 3.49Å; I91-M95 VanDerWaalsContact O-CB 3.29Å; I91-M95 WeakPolarHBondContact O-CB 3.37Å; I91-M95 VanDerWaalsContact O-CG 3.23Å; I91-M95 WeakPolarHBondContact O-CG 3.5Å; I91-M95 PolarHBondContact O-N 2.86Å; M95-S97 PolarHBondContact O-N 3.3Å; M95-I103 HydrophobicContact CE-CD1 3.59Å; M95-I103 HydrophobicContact SD-CD1 3.49Å; M95-I103 WeakPolarHBondContact SD-CD1 3.33Å
96	A	62.5	Low	63.3	Low	89 Å²	89	86 Å²	86	74%	0.736	50%	0.498	S	S	*	.	H	α-helix	trans	-61.7	-23.2	172.8	0	0	0	0	0	112.1	E92 L93	E92-A96 VanDerWaalsContact O-CB 3.31Å; E92-A96 WeakPolarHBondContact O-CB 3.36Å; E92-A96 PolarHBondContact O-N 2.81Å; L93-A96 PolarHBondContact O-N 2.84Å
97	S	64.6	Low	64	Low	90 Å²	90	84.4 Å²	84.4	63%	0.629	50%	0.495	S	S	*	.	H	α-helix	trans	-106.7	-10.6	-178.4	63.4	0	0	0	0	115.9	L93 A94 M95	L93-S97 PolarHBondContact O-N 3.29Å; L93-S97 PolarHBondContact O-OG 3.22Å; A94-S97 WeakPolarHBondContact CA-OG 3.38Å; A94-S97 PolarHBondContact O-N 3.49Å; A94-S97 PolarHBondContact O-OG 2.95Å; A94-S97 VanDerWaalsContact O-OG 3.05Å; M95-S97 PolarHBondContact O-N 3.3Å
98	S	62.7	Low	65.4	Low	48 Å²	48	84.3 Å²	84.3	34%	0.336	49%	0.487	S	S	.	.	S	Bend	trans	-102.2	126.8	-177.4	-59.5	0	0	0	0	111.7	A94 I100	A94-S98 VanDerWaalsContact O-CB 3.26Å; A94-S98 WeakPolarHBondContact O-CB 3.24Å; A94-S98 PolarHBondContact O-N 3.45Å; A94-S98 PolarHBondContact O-OG 3.31Å; S98-I100 PolarHBondContact O-N 3.09Å
99	P	67	Low	66.9	Low	69 Å²	69	85.6 Å²	85.6	45%	0.448	49%	0.488	S	S	.	.			trans	-54.9	135.9	169.7	-24.2	33.7	0	0	0	111.5	T101 D102	P99-T101 WeakPolarHBondContact CB-OG1 3.38Å; P99-T101 PolarHBondContact O-N 2.66Å; P99-T101 VanDerWaalsContact O-N 3.11Å; P99-D102 WeakPolarHBondContact CD-OD2 3.39Å; P99-D102 PolarHBondContact O-N 2.62Å
100	I	68.9	Low	68.5	Low	129 Å²	129	83.1 Å²	83.1	66%	0.662	47%	0.468	S	S	*	.	H	α-helix	trans	-55.1	-33	177.5	-64.9	171.6	0	0	0	111.1	S98 D102 I103 I104	S98-I100 PolarHBondContact O-N 3.09Å; I100-D102 VanDerWaalsContact C-N 3.34Å; I100-D102 PolarHBondContact O-N 2.78Å; I100-I103 PolarHBondContact O-N 3.36Å; I100-I104 HydrophobicContact CG2-CD1 3.82Å; I100-I104 HydrophobicContact CG2-CG1 4.36Å; I100-I104 WeakPolarHBondContact O-CG1 3.3Å; I100-I104 PolarHBondContact O-N 3.14Å
101	T	68.2	Low	70.2	Confident	93 Å²	93	79.4 Å²	79.4	57%	0.571	44%	0.444	S	S	*	.	H	α-helix	trans	-58.9	-41.4	177.3	48.7	0	0	0	0	112.8	P99 I103 I104 Q105	P99-T101 WeakPolarHBondContact CB-OG1 3.38Å; P99-T101 PolarHBondContact O-N 2.66Å; P99-T101 VanDerWaalsContact O-N 3.11Å; T101-I103 VanDerWaalsContact C-N 3.32Å; T101-I103 PolarHBondContact O-N 2.96Å; T101-I104 PolarHBondContact O-N 2.8Å; T101-Q105 WeakPolarHBondContact O-CB 3.31Å; T101-Q105 PolarHBondContact O-N 2.95Å
102	D	71.2	Confident	72	Confident	85 Å²	85	81.1 Å²	81.1	46%	0.455	45%	0.452	S	S	.	.	H	α-helix	trans	-70.9	-34.5	-176.5	-60.8	-4.4	0	0	0	110.6	P99 I100 S106	P99-D102 WeakPolarHBondContact CD-OD2 3.39Å; P99-D102 PolarHBondContact O-N 2.62Å; I100-D102 VanDerWaalsContact C-N 3.34Å; I100-D102 PolarHBondContact O-N 2.78Å; D102-S106 VanDerWaalsContact O-CB 3.26Å; D102-S106 WeakPolarHBondContact O-CB 3.37Å; D102-S106 PolarHBondContact O-N 2.97Å; D102-S106 PolarHBondContact O-OG 3.42Å
103	I	68	Low	73.8	Confident	26 Å²	26	77.5 Å²	77.5	13%	0.133	44%	0.438	C	S	.	.	H	α-helix	trans	-67	-44.4	175	-58.3	171.9	0	0	0	110.5	I85 F86 M95 I100 T101 S106 T107	I85-I103 HydrophobicContact CD1-CG2 4.38Å; F86-I103 HydrophobicContact CE2-CD1 4.26Å; F86-I103 HydrophobicContact CE2-CG2 3.67Å; F86-I103 HydrophobicContact CZ-CB 4.44Å; F86-I103 HydrophobicContact CZ-CD1 3.68Å; F86-I103 HydrophobicContact CZ-CG1 3.89Å; F86-I103 HydrophobicContact CZ-CG2 3.72Å; M95-I103 HydrophobicContact CE-CD1 3.59Å; M95-I103 HydrophobicContact SD-CD1 3.49Å; M95-I103 WeakPolarHBondContact SD-CD1 3.33Å; I100-I103 PolarHBondContact O-N 3.36Å; T101-I103 VanDerWaalsContact C-N 3.32Å; T101-I103 PolarHBondContact O-N 2.96Å; I103-S106 WeakPolarHBondContact CA-OG 3.48Å; I103-S106 PolarHBondContact O-OG 3.35Å; I103-T107 WeakPolarHBondContact O-CB 3.46Å; I103-T107 PolarHBondContact O-N 3.44Å; I103-T107 PolarHBondContact O-OG1 2.94Å
104	I	72.5	Confident	75.4	Confident	108 Å²	108	71 Å²	71	55%	0.554	40%	0.404	S	S	*	.	H	α-helix	trans	-63.4	-48	177	-67.9	168.8	0	0	0	110.1	I100 T101 T107 Q108	I100-I104 HydrophobicContact CG2-CD1 3.82Å; I100-I104 HydrophobicContact CG2-CG1 4.36Å; I100-I104 WeakPolarHBondContact O-CG1 3.3Å; I100-I104 PolarHBondContact O-N 3.14Å; T101-I104 PolarHBondContact O-N 2.8Å; I104-T107 WeakPolarHBondContact O-CB 3.47Å; I104-T107 PolarHBondContact O-N 2.91Å; I104-Q108 PolarHBondContact O-N 3.44Å
105	Q	75.5	Confident	77.1	Confident	112 Å²	112	71.8 Å²	71.8	52%	0.523	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-49.2	-179.4	-179.9	174	-17.9	0	0	111.5	T101 T107 Q108 E109	T101-Q105 WeakPolarHBondContact O-CB 3.31Å; T101-Q105 PolarHBondContact O-N 2.95Å; Q105-T107 VanDerWaalsContact C-N 3.28Å; Q105-T107 PolarHBondContact O-N 3.26Å; Q105-Q108 PolarHBondContact O-N 2.79Å; Q105-Q108 VanDerWaalsContact O-N 3.09Å; Q105-E109 HydrophobicContact CG-CG 4.42Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.38Å; Q105-E109 PolarHBondContact NE2-OE1 3.1Å; Q105-E109 WeakPolarHBondContact O-CG 3.41Å; Q105-E109 PolarHBondContact O-N 2.91Å
106	S	75.2	Confident	78.9	Confident	39 Å²	39	73.7 Å²	73.7	27%	0.273	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-35.5	177.9	60.4	0	0	0	0	112.4	D102 I103 N110	D102-S106 VanDerWaalsContact O-CB 3.26Å; D102-S106 WeakPolarHBondContact O-CB 3.37Å; D102-S106 PolarHBondContact O-N 2.97Å; D102-S106 PolarHBondContact O-OG 3.42Å; I103-S106 WeakPolarHBondContact CA-OG 3.48Å; I103-S106 PolarHBondContact O-OG 3.35Å; S106-N110 WeakPolarHBondContact O-CB 3.39Å; S106-N110 VanDerWaalsContact O-CG 3.22Å; S106-N110 PolarHBondContact O-N 3.32Å; S106-N110 PolarHBondContact O-ND2 3.49Å
107	T	78.4	Confident	80.5	Confident	40 Å²	40	70.7 Å²	70.7	25%	0.245	38%	0.377	C	S	.	.	H	α-helix	trans	-62.7	-46.8	172.5	-57.6	0	0	0	0	111.1	I85 I103 I104 Q105 N110 I111	I85-T107 WeakPolarHBondContact CD1-OG1 3.33Å; I103-T107 WeakPolarHBondContact O-CB 3.46Å; I103-T107 PolarHBondContact O-N 3.44Å; I103-T107 PolarHBondContact O-OG1 2.94Å; I104-T107 WeakPolarHBondContact O-CB 3.47Å; I104-T107 PolarHBondContact O-N 2.91Å; Q105-T107 VanDerWaalsContact C-N 3.28Å; Q105-T107 PolarHBondContact O-N 3.26Å; T107-N110 PolarHBondContact O-N 2.9Å; T107-I111 HydrophobicContact CG2-CD1 4.09Å; T107-I111 WeakPolarHBondContact O-CG1 3.36Å; T107-I111 PolarHBondContact O-N 3.29Å
108	Q	83.3	Confident	82.1	Confident	101 Å²	101	66.4 Å²	66.4	47%	0.472	35%	0.348	S	S	.	.	H	α-helix	trans	-63.9	-44.3	-179.6	-172.3	61.8	17.1	0	0	111.6	I104 Q105 N110 I111 E112	I104-Q108 PolarHBondContact O-N 3.44Å; Q105-Q108 PolarHBondContact O-N 2.79Å; Q105-Q108 VanDerWaalsContact O-N 3.09Å; Q108-N110 VanDerWaalsContact C-N 3.33Å; Q108-N110 PolarHBondContact O-N 2.96Å; Q108-I111 PolarHBondContact O-N 2.69Å; Q108-E112 WeakPolarHBondContact O-CG 3.48Å; Q108-E112 PolarHBondContact O-N 2.96Å
109	E	86.7	Confident	83.8	Confident	97 Å²	97	68.8 Å²	68.8	45%	0.453	35%	0.353	S	S	.	.	H	α-helix	trans	-60.4	-42.3	175.7	-73.1	176.6	-170.4	0	0	111.8	Q105 I111 E112 N113	Q105-E109 HydrophobicContact CG-CG 4.42Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.38Å; Q105-E109 PolarHBondContact NE2-OE1 3.1Å; Q105-E109 WeakPolarHBondContact O-CG 3.41Å; Q105-E109 PolarHBondContact O-N 2.91Å; E109-I111 VanDerWaalsContact C-N 3.34Å; E109-I111 PolarHBondContact O-N 2.76Å; E109-E112 PolarHBondContact O-N 2.94Å; E109-N113 WeakPolarHBondContact O-CB 3.37Å; E109-N113 PolarHBondContact O-N 3.34Å; E109-N113 PolarHBondContact O-ND2 2.99Å
110	N	87.9	Confident	85.3	Confident	68 Å²	68	72.7 Å²	72.7	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-62.5	-40	175.9	-78	-43.4	0	0	0	112.4	I82 S106 T107 Q108 A114	I82-N110 HydrophobicContact CD1-CB 4.37Å; I82-N110 HydrophobicContact CG2-CB 4.17Å; S106-N110 WeakPolarHBondContact O-CB 3.39Å; S106-N110 VanDerWaalsContact O-CG 3.22Å; S106-N110 PolarHBondContact O-N 3.32Å; S106-N110 PolarHBondContact O-ND2 3.49Å; T107-N110 PolarHBondContact O-N 2.9Å; Q108-N110 VanDerWaalsContact C-N 3.33Å; Q108-N110 PolarHBondContact O-N 2.96Å; N110-A114 WeakPolarHBondContact O-CB 3.49Å; N110-A114 PolarHBondContact O-N 3.4Å
111	I	90.5	Very high	86.7	Confident	26 Å²	26	67.5 Å²	67.5	13%	0.133	34%	0.335	C	S	.	.	H	α-helix	trans	-64.7	-46.4	175.5	-69.5	167.9	0	0	0	110.6	I82 T107 Q108 E109 N113 A114 K115 V138	I82-I111 HydrophobicContact CD1-CB 4.29Å; I82-I111 HydrophobicContact CD1-CG1 3.65Å; T107-I111 HydrophobicContact CG2-CD1 4.09Å; T107-I111 WeakPolarHBondContact O-CG1 3.36Å; T107-I111 PolarHBondContact O-N 3.29Å; Q108-I111 PolarHBondContact O-N 2.69Å; E109-I111 VanDerWaalsContact C-N 3.34Å; E109-I111 PolarHBondContact O-N 2.76Å; I111-N113 PolarHBondContact O-N 2.92Å; I111-A114 PolarHBondContact O-N 2.65Å; I111-K115 HydrophobicContact CG2-CD 4.29Å; I111-K115 WeakPolarHBondContact O-CG 3.49Å; I111-K115 PolarHBondContact O-N 3Å; I111-V138 HydrophobicContact CD1-CG1 4.3Å; I111-V138 HydrophobicContact CD1-CG2 4.22Å; I111-V138 HydrophobicContact CG1-CG1 4.42Å; I111-V138 HydrophobicContact CG1-CG2 4.12Å
112	E	92.7	Very high	88.1	Confident	63 Å²	63	64.5 Å²	64.5	29%	0.294	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-40	179.1	-71.7	-53.1	134.1	0	0	112.2	Q108 E109 A114 K115 K116	Q108-E112 WeakPolarHBondContact O-CG 3.48Å; Q108-E112 PolarHBondContact O-N 2.96Å; E109-E112 PolarHBondContact O-N 2.94Å; E112-A114 PolarHBondContact O-N 2.9Å; E112-K115 PolarHBondContact O-N 3.02Å; E112-K115 IonicContact OE1-NZ 3.81Å; E112-K115 PolarHBondContact OE1-NZ 3.47Å; E112-K116 WeakPolarHBondContact O-CB 3.42Å; E112-K116 VanDerWaalsContact O-CG 3.3Å; E112-K116 WeakPolarHBondContact O-CG 3.34Å; E112-K116 PolarHBondContact O-N 2.88Å
113	N	94.3	Very high	89.4	Confident	92 Å²	92	65.6 Å²	65.6	49%	0.492	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-40.7	174.3	-71.6	-27	0	0	0	112	E109 I111 K116 L117	E109-N113 WeakPolarHBondContact O-CB 3.37Å; E109-N113 PolarHBondContact O-N 3.34Å; E109-N113 PolarHBondContact O-ND2 2.99Å; I111-N113 PolarHBondContact O-N 2.92Å; N113-K116 PolarHBondContact O-N 3.43Å; N113-L117 WeakPolarHBondContact O-CB 3.42Å; N113-L117 PolarHBondContact O-N 3.03Å
114	A	93.9	Very high	90.8	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-44.6	174.6	0	0	0	0	0	112	Y80 I82 N110 I111 E112 L117 L118 V136	Y80-A114 HydrophobicContact CD1-CB 3.55Å; Y80-A114 HydrophobicContact CE1-CB 3.8Å; Y80-A114 HydrophobicContact CG-CB 4.08Å; I82-A114 HydrophobicContact CD1-CB 4.05Å; I82-A114 HydrophobicContact CG1-CB 4.26Å; N110-A114 WeakPolarHBondContact O-CB 3.49Å; N110-A114 PolarHBondContact O-N 3.4Å; I111-A114 PolarHBondContact O-N 2.65Å; E112-A114 PolarHBondContact O-N 2.9Å; A114-L117 PolarHBondContact O-N 2.88Å; A114-L118 WeakPolarHBondContact O-CB 3.15Å; A114-L118 WeakPolarHBondContact O-CG 3.37Å; A114-L118 PolarHBondContact O-N 3.14Å; A114-V136 HydrophobicContact CB-CG1 4.29Å; A114-V136 HydrophobicContact CB-CG2 4.33Å
115	K	95.4	Very high	91.9	Very high	54 Å²	54	62.4 Å²	62.4	24%	0.235	30%	0.302	C	S	.	.	H	α-helix	trans	-60	-47.9	175.3	-72.8	175.2	-173.6	167.6	0	111.5	I111 E112 L117 L118 Q119	I111-K115 HydrophobicContact CG2-CD 4.29Å; I111-K115 WeakPolarHBondContact O-CG 3.49Å; I111-K115 PolarHBondContact O-N 3Å; E112-K115 PolarHBondContact O-N 3.02Å; E112-K115 IonicContact OE1-NZ 3.81Å; E112-K115 PolarHBondContact OE1-NZ 3.47Å; K115-L117 VanDerWaalsContact C-N 3.32Å; K115-L117 PolarHBondContact O-N 3.3Å; K115-L118 PolarHBondContact O-N 3.36Å; K115-Q119 WeakPolarHBondContact O-CB 3.14Å; K115-Q119 WeakPolarHBondContact O-CG 3.33Å; K115-Q119 PolarHBondContact O-N 3.46Å
116	K	97.2	Very high	92.8	Very high	118 Å²	118	63.7 Å²	63.7	51%	0.513	31%	0.306	S	S	.	.	H	α-helix	trans	-58.7	-43.6	177.5	-74.7	172.8	-176.1	174.1	0	111.7	E112 N113 K120	E112-K116 WeakPolarHBondContact O-CB 3.42Å; E112-K116 VanDerWaalsContact O-CG 3.3Å; E112-K116 WeakPolarHBondContact O-CG 3.34Å; E112-K116 PolarHBondContact O-N 2.88Å; N113-K116 PolarHBondContact O-N 3.43Å; K116-K120 WeakPolarHBondContact O-CG 3.47Å; K116-K120 PolarHBondContact O-N 3.2Å
117	L	96.8	Very high	93.8	Very high	25 Å²	25	71.7 Å²	71.7	13%	0.131	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-50.5	176.1	178.9	70.8	0	0	0	111.2	D53 A54 Y80 N113 A114 K115 Q119 K120 Y121	D53-L117 VanDerWaalsContact C-CD2 3.43Å; A54-L117 HydrophobicContact CB-CD1 4.41Å; A54-L117 HydrophobicContact CB-CD2 4.42Å; Y80-L117 HydrophobicContact CD2-CD2 3.51Å; Y80-L117 HydrophobicContact CE2-CD2 3.48Å; Y80-L117 VanDerWaalsContact CE2-CD2 3.48Å; N113-L117 WeakPolarHBondContact O-CB 3.42Å; N113-L117 PolarHBondContact O-N 3.03Å; A114-L117 PolarHBondContact O-N 2.88Å; K115-L117 VanDerWaalsContact C-N 3.32Å; K115-L117 PolarHBondContact O-N 3.3Å; L117-Q119 VanDerWaalsContact C-N 3.33Å; L117-Q119 PolarHBondContact O-N 3.05Å; L117-K120 WeakPolarHBondContact O-CB 3.44Å; L117-K120 PolarHBondContact O-N 3.24Å; L117-K120 VanDerWaalsContact O-N 3.12Å; L117-Y121 HydrophobicContact CD1-CD2 4.47Å; L117-Y121 HydrophobicContact CD1-CE2 3.86Å; L117-Y121 HydrophobicContact CG-CD2 4.28Å; L117-Y121 HydrophobicContact CG-CE2 3.96Å; L117-Y121 WeakPolarHBondContact O-CD2 3.43Å; L117-Y121 PolarHBondContact O-N 3.34Å
118	L	98.1	Very high	94.5	Very high	1 Å²	1	73.7 Å²	73.7	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-36.9	-179.2	-73.5	168.2	0	0	0	112.5	V52 F78 A114 K115 K120 Y121 L122 A134 V136	V52-L118 HydrophobicContact CG2-CD2 3.68Å; F78-L118 HydrophobicContact CB-CD2 3.7Å; A114-L118 WeakPolarHBondContact O-CB 3.15Å; A114-L118 WeakPolarHBondContact O-CG 3.37Å; A114-L118 PolarHBondContact O-N 3.14Å; K115-L118 PolarHBondContact O-N 3.36Å; L118-K120 VanDerWaalsContact C-N 3.28Å; L118-K120 PolarHBondContact O-N 2.88Å; L118-Y121 WeakPolarHBondContact O-CB 3.27Å; L118-Y121 PolarHBondContact O-N 2.86Å; L118-Y121 VanDerWaalsContact O-N 3.1Å; L118-L122 WeakPolarHBondContact O-CG 3.33Å; L118-L122 PolarHBondContact O-N 3.34Å; L118-A134 HydrophobicContact CB-CB 3.89Å; L118-A134 HydrophobicContact CD1-CB 4.14Å; L118-A134 HydrophobicContact CD2-CB 4.05Å; L118-A134 HydrophobicContact CG-CB 4.25Å; L118-V136 HydrophobicContact CD1-CG2 3.31Å
119	Q	97.8	Very high	94.9	Very high	98 Å²	98	71 Å²	71	46%	0.458	33%	0.334	S	S	.	.	H	α-helix	trans	-57.7	-39.9	172.9	-77.7	177	-1.2	0	0	112.1	K115 L117 Y121 L122 I123	K115-Q119 WeakPolarHBondContact O-CB 3.14Å; K115-Q119 WeakPolarHBondContact O-CG 3.33Å; K115-Q119 PolarHBondContact O-N 3.46Å; L117-Q119 VanDerWaalsContact C-N 3.33Å; L117-Q119 PolarHBondContact O-N 3.05Å; Q119-Y121 VanDerWaalsContact C-N 3.31Å; Q119-Y121 PolarHBondContact O-N 3.49Å; Q119-L122 PolarHBondContact O-N 2.87Å; Q119-I123 WeakPolarHBondContact O-CB 3.23Å; Q119-I123 VanDerWaalsContact O-CG1 3.28Å; Q119-I123 WeakPolarHBondContact O-CG1 3.36Å; Q119-I123 PolarHBondContact O-N 3.39Å
120	K	98.1	Very high	95.3	Very high	150 Å²	150	67 Å²	67	65%	0.652	32%	0.316	S	S	*	.	H	α-helix	trans	-59.7	-42.1	175	-66	174.4	-179.5	-178.2	0	111.6	K116 L117 L118 K124	K116-K120 WeakPolarHBondContact O-CG 3.47Å; K116-K120 PolarHBondContact O-N 3.2Å; L117-K120 WeakPolarHBondContact O-CB 3.44Å; L117-K120 PolarHBondContact O-N 3.24Å; L117-K120 VanDerWaalsContact O-N 3.12Å; L118-K120 VanDerWaalsContact C-N 3.28Å; L118-K120 PolarHBondContact O-N 2.88Å; K120-K124 WeakPolarHBondContact O-CB 3.11Å; K120-K124 PolarHBondContact O-N 2.94Å
121	Y	98.3	Very high	95.6	Very high	20 Å²	20	65.3 Å²	65.3	8%	0.078	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-44.9	176.7	-76.5	-76.6	0	0	0	112.4	V52 S58 A59 F62 F78 L117 L118 Q119 K124 A125	V52-Y121 HydrophobicContact CB-CD2 4.39Å; V52-Y121 HydrophobicContact CB-CE2 3.88Å; V52-Y121 HydrophobicContact CG1-CD1 4.41Å; V52-Y121 HydrophobicContact CG1-CD2 4.41Å; V52-Y121 HydrophobicContact CG1-CE1 4.03Å; V52-Y121 HydrophobicContact CG1-CE2 4.03Å; V52-Y121 HydrophobicContact CG2-CD2 4.19Å; V52-Y121 HydrophobicContact CG2-CE2 4.11Å; S58-Y121 WeakPolarHBondContact CB-OH 3.43Å; A59-Y121 WeakPolarHBondContact CA-OH 3.36Å; A59-Y121 PolarHBondContact N-OH 3.49Å; A59-Y121 VanDerWaalsContact N-OH 3.1Å; F62-Y121 HydrophobicContact CB-CD1 4.29Å; F62-Y121 HydrophobicContact CB-CE1 3.97Å; F62-Y121 AromaticContact CD1-CD1 3.5Å; F62-Y121 HydrophobicContact CD1-CD1 3.5Å; F62-Y121 AromaticContact CD1-CE1 3.84Å; F62-Y121 HydrophobicContact CD1-CE1 3.84Å; F62-Y121 HydrophobicContact CE1-CD1 4.09Å; F62-Y121 HydrophobicContact CG-CD1 4.11Å; F62-Y121 HydrophobicContact CG-CE1 4.27Å; F78-Y121 HydrophobicContact CD1-CD1 4.06Å; F78-Y121 HydrophobicContact CD1-CG 4.07Å; F78-Y121 AromaticContact CE1-CD1 3.68Å; F78-Y121 HydrophobicContact CE1-CD1 3.68Å; F78-Y121 HydrophobicContact CE1-CG 4.07Å; F78-Y121 HydrophobicContact CG-CG 4.5Å; F78-Y121 HydrophobicContact CZ-CD1 4.21Å; F78-Y121 HydrophobicContact CZ-CG 4.49Å; L117-Y121 HydrophobicContact CD1-CD2 4.47Å; L117-Y121 HydrophobicContact CD1-CE2 3.86Å; L117-Y121 HydrophobicContact CG-CD2 4.28Å; L117-Y121 HydrophobicContact CG-CE2 3.96Å; L117-Y121 WeakPolarHBondContact O-CD2 3.43Å; L117-Y121 PolarHBondContact O-N 3.34Å; L118-Y121 WeakPolarHBondContact O-CB 3.27Å; L118-Y121 PolarHBondContact O-N 2.86Å; L118-Y121 VanDerWaalsContact O-N 3.1Å; Q119-Y121 VanDerWaalsContact C-N 3.31Å; Q119-Y121 PolarHBondContact O-N 3.49Å; Y121-K124 PolarHBondContact O-N 3.32Å; Y121-A125 WeakPolarHBondContact O-CB 3.49Å; Y121-A125 PolarHBondContact O-N 3.21Å
122	L	98	Very high	95.9	Very high	31 Å²	31	65 Å²	65	16%	0.162	31%	0.309	C	S	.	.	H	α-helix	trans	-59.3	-47.5	176.6	-70.1	175.7	0	0	0	111.8	L7 F78 L118 Q119 K124 A125 K126 C132 A134	L7-L122 HydrophobicContact CB-CD1 4.28Å; L7-L122 HydrophobicContact CD1-CD1 4.13Å; F78-L122 HydrophobicContact CD2-CD2 4.32Å; L118-L122 WeakPolarHBondContact O-CG 3.33Å; L118-L122 PolarHBondContact O-N 3.34Å; Q119-L122 PolarHBondContact O-N 2.87Å; L122-K124 VanDerWaalsContact C-N 3.34Å; L122-K124 PolarHBondContact O-N 3.27Å; L122-A125 PolarHBondContact O-N 3.39Å; L122-K126 WeakPolarHBondContact O-CB 3.1Å; L122-K126 PolarHBondContact O-N 3.03Å; L122-C132 HydrophobicContact CD2-CB 4.12Å; L122-A134 HydrophobicContact CD1-CB 3.8Å; L122-A134 HydrophobicContact CD2-CB 3.94Å; L122-A134 HydrophobicContact CG-CB 3.94Å
123	I	98.2	Very high	96.1	Very high	108 Å²	108	62.4 Å²	62.4	55%	0.554	30%	0.297	S	S	*	.	H	α-helix	trans	-60.6	-45.7	177.6	-69.7	165.9	0	0	0	110.2	Q119 K126 R127	Q119-I123 WeakPolarHBondContact O-CB 3.23Å; Q119-I123 VanDerWaalsContact O-CG1 3.28Å; Q119-I123 WeakPolarHBondContact O-CG1 3.36Å; Q119-I123 PolarHBondContact O-N 3.39Å; I123-K126 PolarHBondContact O-N 2.97Å; I123-R127 WeakPolarHBondContact O-CG 3.06Å; I123-R127 PolarHBondContact O-N 2.56Å
124	K	97.6	Very high	96.3	Very high	66 Å²	66	58 Å²	58	29%	0.287	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-46.6	178.6	-175.8	173.5	176	-178.3	0	111	F62 K120 Y121 L122 K126 R127 F128	F62-K124 HydrophobicContact CD1-CD 4.07Å; F62-K124 HydrophobicContact CE1-CB 3.92Å; F62-K124 HydrophobicContact CE1-CD 3.66Å; F62-K124 HydrophobicContact CE1-CG 3.66Å; F62-K124 HydrophobicContact CZ-CG 4.34Å; K120-K124 WeakPolarHBondContact O-CB 3.11Å; K120-K124 PolarHBondContact O-N 2.94Å; Y121-K124 PolarHBondContact O-N 3.32Å; L122-K124 VanDerWaalsContact C-N 3.34Å; L122-K124 PolarHBondContact O-N 3.27Å; K124-K126 PolarHBondContact O-N 3.44Å; K124-R127 WeakPolarHBondContact O-CB 3.45Å; K124-R127 PolarHBondContact O-N 3.37Å; K124-F128 HydrophobicContact CG-CD2 4.45Å; K124-F128 HydrophobicContact CG-CE2 4.19Å; K124-F128 VanDerWaalsContact O-CD2 3.25Å; K124-F128 WeakPolarHBondContact O-CD2 3.15Å; K124-F128 PolarHBondContact O-N 3.16Å
125	A	96.2	Very high	96.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-42.7	176.4	0	0	0	0	0	112.7	F62 F78 Y121 L122 R127 F128 G129 I130 C132	F62-A125 HydrophobicContact CZ-CB 3.89Å; F78-A125 HydrophobicContact CE2-CB 3.92Å; F78-A125 HydrophobicContact CZ-CB 4.21Å; Y121-A125 WeakPolarHBondContact O-CB 3.49Å; Y121-A125 PolarHBondContact O-N 3.21Å; L122-A125 PolarHBondContact O-N 3.39Å; A125-R127 VanDerWaalsContact C-N 3.31Å; A125-R127 PolarHBondContact O-N 3.11Å; A125-F128 CarbonylContact O-C 3.57Å; A125-F128 PolarHBondContact O-N 2.93Å; A125-G129 PolarHBondContact O-N 2.8Å; A125-I130 HydrophobicContact CB-CB 4.47Å; A125-I130 PolarHBondContact O-N 3.45Å; A125-C132 HydrophobicContact CB-CB 4Å; A125-C132 VanDerWaalsContact CB-SG 3.55Å
126	K	94.2	Very high	96.5	Very high	140 Å²	140	56.3 Å²	56.3	61%	0.609	27%	0.267	S	S	*	.	H	α-helix	trans	-60.4	-38.2	176.1	-172.9	172.6	-179.1	172.4	0	112.4	L122 I123 K124 F128 G129	L122-K126 WeakPolarHBondContact O-CB 3.1Å; L122-K126 PolarHBondContact O-N 3.03Å; I123-K126 PolarHBondContact O-N 2.97Å; K124-K126 PolarHBondContact O-N 3.44Å; K126-F128 PolarHBondContact O-N 3.25Å; K126-G129 PolarHBondContact O-N 3.04Å
127	R	96.1	Very high	96.4	Very high	206 Å²	206	51.2 Å²	51.2	78%	0.777	25%	0.246	S	C	*	.	H	α-helix	trans	-60.9	-25.6	174.2	-72.2	171.8	62.6	-177.4	0.6	113.4	I123 K124 A125	I123-R127 WeakPolarHBondContact O-CG 3.06Å; I123-R127 PolarHBondContact O-N 2.56Å; K124-R127 WeakPolarHBondContact O-CB 3.45Å; K124-R127 PolarHBondContact O-N 3.37Å; A125-R127 VanDerWaalsContact C-N 3.31Å; A125-R127 PolarHBondContact O-N 3.11Å
128	F	92.9	Very high	96.1	Very high	83 Å²	83	52.1 Å²	52.1	36%	0.364	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	6.9	175.7	-73.4	-84.2	0	0	0	113.4	L66 R70 K124 A125 K126 I130	L66-F128 HydrophobicContact CD1-CD2 3.88Å; L66-F128 HydrophobicContact CD1-CE2 3.7Å; L66-F128 HydrophobicContact CD1-CZ 4.15Å; L66-F128 HydrophobicContact CD2-CB 4.13Å; L66-F128 HydrophobicContact CD2-CD1 4.45Å; L66-F128 HydrophobicContact CD2-CD2 3.98Å; L66-F128 HydrophobicContact CD2-CG 3.94Å; R70-F128 PolarHBondContact NH1-O 3.14Å; K124-F128 HydrophobicContact CG-CD2 4.45Å; K124-F128 HydrophobicContact CG-CE2 4.19Å; K124-F128 VanDerWaalsContact O-CD2 3.25Å; K124-F128 WeakPolarHBondContact O-CD2 3.15Å; K124-F128 PolarHBondContact O-N 3.16Å; A125-F128 CarbonylContact O-C 3.57Å; A125-F128 PolarHBondContact O-N 2.93Å; K126-F128 PolarHBondContact O-N 3.25Å; F128-I130 VanDerWaalsContact C-N 3.34Å; F128-I130 HydrophobicContact CB-CD1 3.85Å; F128-I130 HydrophobicContact CB-CG1 3.95Å
129	G	92.9	Very high	95.6	Very high	44 Å²	44	57.2 Å²	57.2	45%	0.454	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	24.8	179.5	0	0	0	0	0	114.2	A125 K126	A125-G129 PolarHBondContact O-N 2.8Å; K126-G129 PolarHBondContact O-N 3.04Å
130	I	93.4	Very high	95.2	Very high	12 Å²	12	53.5 Å²	53.5	6%	0.062	27%	0.265	C	S	.	.			trans	-99.3	128.8	-173.7	-53	177.3	0	0	0	109.6	Y65 L66 R70 L76 A125 F128 C132	Y65-I130 HydrophobicContact CE1-CD1 3.82Å; L66-I130 HydrophobicContact CD2-CD1 3.38Å; R70-I130 VanDerWaalsContact CD-CD1 3.43Å; R70-I130 HydrophobicContact CG-CD1 3.87Å; R70-I130 HydrophobicContact CG-CG1 4.36Å; L76-I130 HydrophobicContact CB-CG2 4.3Å; L76-I130 HydrophobicContact CD1-CG2 3.87Å; L76-I130 HydrophobicContact CD2-CG2 4.37Å; L76-I130 HydrophobicContact CG-CG2 4.4Å; A125-I130 HydrophobicContact CB-CB 4.47Å; A125-I130 PolarHBondContact O-N 3.45Å; F128-I130 VanDerWaalsContact C-N 3.34Å; F128-I130 HydrophobicContact CB-CD1 3.85Å; F128-I130 HydrophobicContact CB-CG1 3.95Å; I130-C132 PolarHBondContact O-N 3.47Å
131	S	94.8	Very high	95	Very high	34 Å²	34	53.3 Å²	53.3	24%	0.238	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	128.1	171.1	-174.6	0	0	0	0	109.2	E75 L76	E75-S131 WeakPolarHBondContact CA-O 3.42Å; L76-S131 PolarHBondContact N-O 3.45Å
132	C	97	Very high	94.9	Very high	18 Å²	18	53.4 Å²	53.4	12%	0.122	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	152.3	-177.4	56.8	0	0	0	0	113.4	L76 F78 L122 A125 I130	L76-C132 HydrophobicContact CB-CB 3.88Å; L76-C132 CarbonylContact O-C 3.58Å; L76-C132 WeakPolarHBondContact O-CA 3.48Å; L76-C132 WeakPolarHBondContact O-CB 3.07Å; F78-C132 HydrophobicContact CD2-CB 4.42Å; F78-C132 HydrophobicContact CE2-CB 4.07Å; L122-C132 HydrophobicContact CD2-CB 4.12Å; A125-C132 HydrophobicContact CB-CB 4Å; A125-C132 VanDerWaalsContact CB-SG 3.55Å; I130-C132 PolarHBondContact O-N 3.47Å
133	Q	97.5	Very high	94.8	Very high	9 Å²	9	52.1 Å²	52.1	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	155.2	174.6	-69.6	175.7	7.7	0	0	109.1	K6 N9 E75 L76 F78 F135	K6-Q133 VanDerWaalsContact CE-OE1 3.28Å; K6-Q133 VanDerWaalsContact NZ-NE2 3.15Å; K6-Q133 VanDerWaalsContact NZ-OE1 3.16Å; N9-Q133 VanDerWaalsContact OD1-CG 3.31Å; N9-Q133 WeakPolarHBondContact OD1-CG 2.95Å; N9-Q133 PolarHBondContact OD1-NE2 3.41Å; E75-Q133 PolarHBondContact OE1-NE2 3.14Å; L76-Q133 PolarHBondContact O-N 2.82Å; F78-Q133 PolarHBondContact N-O 3.37Å; Q133-F135 HydrophobicContact CB-CE2 3.69Å; Q133-F135 HydrophobicContact CB-CZ 3.93Å
134	A	97.9	Very high	94.8	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	139.4	177	0	0	0	0	0	110.5	L7 F78 L118 L122	L7-A134 HydrophobicContact CD1-CB 4.29Å; F78-A134 CarbonylContact O-C 3.57Å; F78-A134 VanDerWaalsContact O-CA 3.31Å; F78-A134 WeakPolarHBondContact O-CA 3.3Å; L118-A134 HydrophobicContact CB-CB 3.89Å; L118-A134 HydrophobicContact CD1-CB 4.14Å; L118-A134 HydrophobicContact CD2-CB 4.05Å; L118-A134 HydrophobicContact CG-CB 4.25Å; L122-A134 HydrophobicContact CD1-CB 3.8Å; L122-A134 HydrophobicContact CD2-CB 3.94Å; L122-A134 HydrophobicContact CG-CB 3.94Å
135	F	98	Very high	94.8	Very high	7 Å²	7	47.5 Å²	47.5	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.4	-177	-55.9	-90.3	0	0	0	110.3	K6 H77 F78 V79 Y80 Q133 F149	K6-F135 HydrophobicContact CG-CE1 4.46Å; H77-F135 HydrophobicContact CB-CD2 4.39Å; H77-F135 HydrophobicContact CB-CE2 3.97Å; H77-F135 AromaticContact CG-CE2 3.75Å; H77-F135 AromaticContact ND1-CE2 3.89Å; F78-F135 PolarHBondContact O-N 2.9Å; V79-F135 WeakPolarHBondContact CA-O 3.32Å; V79-F135 HydrophobicContact CG2-CB 4.38Å; V79-F135 HydrophobicContact CG2-CD2 4.24Å; Y80-F135 PolarHBondContact N-O 3.24Å; Q133-F135 HydrophobicContact CB-CE2 3.69Å; Q133-F135 HydrophobicContact CB-CZ 3.93Å; F135-F149 HydrophobicContact CB-CE1 3.74Å; F135-F149 HydrophobicContact CB-CZ 4.07Å; F135-F149 HydrophobicContact CD1-CE1 4.06Å; F135-F149 AromaticContact CD1-CZ 3.55Å; F135-F149 HydrophobicContact CD1-CZ 3.55Å; F135-F149 AromaticContact CD2-CE1 3.75Å; F135-F149 HydrophobicContact CD2-CE1 3.75Å; F135-F149 AromaticContact CD2-CZ 3.94Å; F135-F149 HydrophobicContact CD2-CZ 3.94Å; F135-F149 AromaticContact CE1-CZ 3.85Å; F135-F149 HydrophobicContact CE1-CZ 3.85Å; F135-F149 HydrophobicContact CE2-CE1 4.32Å; F135-F149 HydrophobicContact CE2-CZ 4.22Å; F135-F149 AromaticContact CG-CE1 3.58Å; F135-F149 HydrophobicContact CG-CE1 3.58Å; F135-F149 AromaticContact CG-CZ 3.58Å; F135-F149 HydrophobicContact CG-CZ 3.58Å; F135-F149 HydrophobicContact CZ-CZ 4.16Å
136	V	95.8	Very high	94.9	Very high	11 Å²	11	47.9 Å²	47.9	7%	0.067	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.8	172	-177.3	0	0	0	0	108.3	Y80 I82 A114 L118 V138	Y80-V136 WeakPolarHBondContact O-CA 3.46Å; I82-V136 HydrophobicContact CD1-CG1 3.89Å; I82-V136 HydrophobicContact CG1-CG1 4.27Å; A114-V136 HydrophobicContact CB-CG1 4.29Å; A114-V136 HydrophobicContact CB-CG2 4.33Å; L118-V136 HydrophobicContact CD1-CG2 3.31Å; V136-V138 HydrophobicContact CG1-CG2 4.01Å
137	H	95	Very high	95.1	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.056	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.6	166.7	-76.3	-101.6	0	0	0	109.2	Q4 Y80 V81 I82 A140 T145 F149	Q4-H137 PolarHBondContact NE2-CE1 3.39Å; Q4-H137 VanDerWaalsContact NE2-CE1 3.29Å; Q4-H137 PolarHBondContact NE2-NE2 3.02Å; Y80-H137 PolarHBondContact O-N 3.2Å; V81-H137 CarbonylContact C-O 3.57Å; V81-H137 WeakPolarHBondContact CA-O 3.41Å; V81-H137 HydrophobicContact CG1-CB 4.22Å; V81-H137 HydrophobicContact CG2-CB 4.28Å; I82-H137 PolarHBondContact N-O 3.1Å; H137-A140 HydrophobicContact CB-CB 4.49Å; H137-T145 HydrophobicContact CB-CG2 3.77Å; H137-F149 AromaticContact NE2-CD1 3.59Å; H137-F149 AromaticContact NE2-CD2 3.72Å; H137-F149 AromaticContact NE2-CE1 3.88Å; H137-F149 AromaticContact NE2-CE2 3.99Å; H137-F149 AromaticContact NE2-CG 3.55Å
138	V	91	Very high	95.2	Very high	43 Å²	43	38.1 Å²	38.1	26%	0.261	21%	0.212	S	C	.	.			trans	-98	144.4	-177.6	-169.5	0	0	0	0	110.7	I82 I111 V136 A140	I82-V138 HydrophobicContact CD1-CG2 4.24Å; I111-V138 HydrophobicContact CD1-CG1 4.3Å; I111-V138 HydrophobicContact CD1-CG2 4.22Å; I111-V138 HydrophobicContact CG1-CG1 4.42Å; I111-V138 HydrophobicContact CG1-CG2 4.12Å; V136-V138 HydrophobicContact CG1-CG2 4.01Å; V138-A140 VanDerWaalsContact C-N 3.35Å; V138-A140 PolarHBondContact O-N 3.35Å
139	N	86.5	Confident	95.5	Very high	109 Å²	109	34.2 Å²	34.2	58%	0.583	19%	0.194	S	C	*	.	S	Bend	trans	55.9	44.8	173.5	-165.6	26.2	0	0	0	113.1	I82 P84	I82-N139 WeakPolarHBondContact O-CA 3.36Å; I82-N139 PolarHBondContact O-N 3.09Å; P84-N139 WeakPolarHBondContact CA-OD1 3.38Å; P84-N139 WeakPolarHBondContact CB-OD1 3.38Å
140	A	90.7	Very high	95.8	Very high	20 Å²	20	32.1 Å²	32.1	17%	0.165	17%	0.173	C	C	.	.			trans	-133.5	151.2	-172.2	0	0	0	0	0	113.3	V81 I82 P84 H137 V138 P142 T145	V81-A140 HydrophobicContact CG1-CB 3.92Å; V81-A140 WeakPolarHBondContact CG1-O 3.49Å; I82-A140 PolarHBondContact O-N 3.38Å; P84-A140 WeakPolarHBondContact CD-O 3.41Å; H137-A140 HydrophobicContact CB-CB 4.49Å; V138-A140 VanDerWaalsContact C-N 3.35Å; V138-A140 PolarHBondContact O-N 3.35Å; A140-P142 WeakPolarHBondContact O-CD 3.41Å; A140-T145 HydrophobicContact CB-CG2 4.47Å; A140-T145 WeakPolarHBondContact CB-OG1 3.46Å
141	K	93.4	Very high	96	Very high	145 Å²	145	35.1 Å²	35.1	63%	0.63	19%	0.187	S	C	*	.			trans	-76	116.3	177.5	-68.4	-177.7	-178.8	176.5	0	109.3	G143 P144 T145	K141-G143 PolarHBondContact O-N 3.33Å; K141-P144 HydrophobicContact CB-CG 4.13Å; K141-P144 WeakPolarHBondContact O-CD 3.4Å; K141-T145 WeakPolarHBondContact O-CB 3.41Å; K141-T145 PolarHBondContact O-N 3.35Å; K141-T145 VanDerWaalsContact O-N 3.09Å; K141-T145 PolarHBondContact O-OG1 2.78Å
142	P	95.3	Very high	96.1	Very high	22 Å²	22	37.8 Å²	37.8	14%	0.143	20%	0.195	C	C	.	.	H	α-helix	trans	-57.8	-48.5	-168.2	-27.5	34.7	0	0	0	114.8	V81 K83 A140 T145 L146 V176	V81-P142 HydrophobicContact CB-CB 4.12Å; V81-P142 HydrophobicContact CB-CG 4.19Å; V81-P142 HydrophobicContact CG1-CB 4.3Å; V81-P142 HydrophobicContact CG1-CG 4.09Å; V81-P142 HydrophobicContact CG2-CB 4.5Å; K83-P142 HydrophobicContact CD-CG 4.38Å; K83-P142 HydrophobicContact CG-CG 3.7Å; A140-P142 WeakPolarHBondContact O-CD 3.41Å; P142-T145 PolarHBondContact O-N 2.9Å; P142-L146 WeakPolarHBondContact O-CB 3.37Å; P142-L146 WeakPolarHBondContact O-CG 3.37Å; P142-L146 PolarHBondContact O-N 3.19Å; P142-V176 HydrophobicContact CB-CG1 3.95Å; P142-V176 HydrophobicContact CB-CG2 3.8Å; P142-V176 HydrophobicContact CG-CG2 4.37Å
143	G	96.7	Very high	96	Very high	5 Å²	5	39.4 Å²	39.4	5%	0.052	20%	0.201	C	C	.	.	H	α-helix	trans	-54.8	-61.6	-178.7	0	0	0	0	0	113.1	K141 T145 L146 V147 Y179	K141-G143 PolarHBondContact O-N 3.33Å; G143-T145 VanDerWaalsContact C-N 3.33Å; G143-T145 PolarHBondContact O-N 3.37Å; G143-L146 PolarHBondContact O-N 3.15Å; G143-V147 WeakPolarHBondContact O-CG2 3.32Å; G143-V147 PolarHBondContact O-N 3.29Å; G143-V147 VanDerWaalsContact O-N 3.14Å; G143-Y179 VanDerWaalsContact C-CE1 3.43Å; G143-Y179 VanDerWaalsContact CA-CD1 3.46Å
144	P	97.8	Very high	95.9	Very high	53 Å²	53	47.1 Å²	47.1	34%	0.344	24%	0.235	S	C	.	.	H	α-helix	trans	-56.7	-42.2	177.2	-25.9	31.6	0	0	0	113.9	K141 V147 K148 Y179	K141-P144 HydrophobicContact CB-CG 4.13Å; K141-P144 WeakPolarHBondContact O-CD 3.4Å; P144-V147 PolarHBondContact O-N 2.78Å; P144-K148 WeakPolarHBondContact O-CB 3.29Å; P144-K148 PolarHBondContact O-N 3.46Å; P144-Y179 HydrophobicContact CB-CE1 4.28Å; P144-Y179 HydrophobicContact CG-CE1 3.9Å; P144-Y179 HydrophobicContact CG-CE2 4.21Å; P144-Y179 VanDerWaalsContact N-CE1 3.32Å
145	T	98	Very high	95.9	Very high	24 Å²	24	47.5 Å²	47.5	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-45.2	179.4	-63.8	0	0	0	0	111.8	V81 H137 A140 K141 P142 G143 F149	V81-T145 HydrophobicContact CG1-CG2 4.41Å; V81-T145 HydrophobicContact CG2-CG2 3.93Å; H137-T145 HydrophobicContact CB-CG2 3.77Å; A140-T145 HydrophobicContact CB-CG2 4.47Å; A140-T145 WeakPolarHBondContact CB-OG1 3.46Å; K141-T145 WeakPolarHBondContact O-CB 3.41Å; K141-T145 PolarHBondContact O-N 3.35Å; K141-T145 VanDerWaalsContact O-N 3.09Å; K141-T145 PolarHBondContact O-OG1 2.78Å; P142-T145 PolarHBondContact O-N 2.9Å; G143-T145 VanDerWaalsContact C-N 3.33Å; G143-T145 PolarHBondContact O-N 3.37Å; T145-F149 WeakPolarHBondContact O-CB 3.28Å; T145-F149 PolarHBondContact O-N 2.9Å
146	L	98.6	Very high	95.8	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-65.6	-40.9	-179.7	-68.3	173.1	0	0	0	111.9	F49 P51 V79 V81 P142 G143 A150 V176 V180	F49-L146 HydrophobicContact CE1-CB 4.45Å; F49-L146 HydrophobicContact CE1-CD2 3.99Å; F49-L146 HydrophobicContact CZ-CD2 4.33Å; P51-L146 HydrophobicContact CB-CD1 3.63Å; P51-L146 HydrophobicContact CB-CD2 3.74Å; P51-L146 HydrophobicContact CB-CG 4.29Å; P51-L146 HydrophobicContact CG-CD1 3.98Å; P51-L146 HydrophobicContact CG-CD2 3.93Å; P51-L146 HydrophobicContact CG-CG 4.41Å; V79-L146 HydrophobicContact CB-CD2 4.11Å; V79-L146 HydrophobicContact CG1-CD2 3.8Å; V81-L146 HydrophobicContact CG2-CD2 3.95Å; V81-L146 HydrophobicContact CG2-CG 4.21Å; P142-L146 WeakPolarHBondContact O-CB 3.37Å; P142-L146 WeakPolarHBondContact O-CG 3.37Å; P142-L146 PolarHBondContact O-N 3.19Å; G143-L146 PolarHBondContact O-N 3.15Å; L146-A150 VanDerWaalsContact O-CB 3.24Å; L146-A150 WeakPolarHBondContact O-CB 3.07Å; L146-A150 PolarHBondContact O-N 3.09Å; L146-V176 HydrophobicContact CD1-CG1 3.6Å; L146-V180 HydrophobicContact CB-CG2 4.1Å; L146-V180 HydrophobicContact CD1-CG2 4.28Å
147	V	98.7	Very high	95.9	Very high	15 Å²	15	49.4 Å²	49.4	9%	0.091	25%	0.247	C	C	.	.	H	α-helix	trans	-63	-52.2	177.3	171.7	0	0	0	0	110.7	G143 P144 F149 A150 E151 Y179 V180 H183	G143-V147 WeakPolarHBondContact O-CG2 3.32Å; G143-V147 PolarHBondContact O-N 3.29Å; G143-V147 VanDerWaalsContact O-N 3.14Å; P144-V147 PolarHBondContact O-N 2.78Å; V147-F149 VanDerWaalsContact C-N 3.34Å; V147-F149 PolarHBondContact O-N 3.19Å; V147-A150 PolarHBondContact O-N 2.95Å; V147-E151 PolarHBondContact O-N 3.33Å; V147-Y179 HydrophobicContact CG2-CD1 4.15Å; V147-Y179 HydrophobicContact CG2-CE1 4.09Å; V147-V180 HydrophobicContact CG2-CB 4.41Å; V147-V180 HydrophobicContact CG2-CG1 4.48Å; V147-V180 HydrophobicContact CG2-CG2 4.21Å; V147-H183 HydrophobicContact CG1-CB 4.23Å; V147-H183 HydrophobicContact CG2-CB 4.03Å
148	K	98.4	Very high	96.1	Very high	126 Å²	126	48.9 Å²	48.9	55%	0.548	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-45.1	179.7	-172	-178.3	-170.6	-98.2	0	111.5	P144 E151 E152	P144-K148 WeakPolarHBondContact O-CB 3.29Å; P144-K148 PolarHBondContact O-N 3.46Å; K148-E151 PolarHBondContact O-N 3.28Å; K148-E152 WeakPolarHBondContact CE-OE1 3.05Å; K148-E152 IonicContact NZ-OE1 3.87Å; K148-E152 PolarHBondContact NZ-OE1 3.02Å; K148-E152 WeakPolarHBondContact O-CG 3.47Å; K148-E152 PolarHBondContact O-N 3.31Å
149	F	98.3	Very high	96.5	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-72.6	-33.8	-175	-169.2	-126.7	0	0	0	112.4	F49 V79 F135 H137 T145 V147 E151 E152 Q153	F49-F149 HydrophobicContact CE2-CB 4.45Å; F49-F149 AromaticContact CE2-CD1 3.47Å; F49-F149 HydrophobicContact CE2-CD1 3.47Å; F49-F149 VanDerWaalsContact CE2-CD1 3.47Å; F49-F149 AromaticContact CE2-CE1 3.95Å; F49-F149 HydrophobicContact CE2-CE1 3.95Å; F49-F149 HydrophobicContact CE2-CG 4.2Å; F49-F149 HydrophobicContact CZ-CB 4.16Å; F49-F149 AromaticContact CZ-CD1 3.61Å; F49-F149 HydrophobicContact CZ-CD1 3.61Å; F49-F149 HydrophobicContact CZ-CE1 4.44Å; F49-F149 HydrophobicContact CZ-CG 4.28Å; V79-F149 HydrophobicContact CG1-CD1 3.92Å; V79-F149 HydrophobicContact CG1-CE1 4.27Å; V79-F149 HydrophobicContact CG2-CD1 3.85Å; V79-F149 HydrophobicContact CG2-CE1 3.74Å; F135-F149 HydrophobicContact CB-CE1 3.74Å; F135-F149 HydrophobicContact CB-CZ 4.07Å; F135-F149 HydrophobicContact CD1-CE1 4.06Å; F135-F149 AromaticContact CD1-CZ 3.55Å; F135-F149 HydrophobicContact CD1-CZ 3.55Å; F135-F149 AromaticContact CD2-CE1 3.75Å; F135-F149 HydrophobicContact CD2-CE1 3.75Å; F135-F149 AromaticContact CD2-CZ 3.94Å; F135-F149 HydrophobicContact CD2-CZ 3.94Å; F135-F149 AromaticContact CE1-CZ 3.85Å; F135-F149 HydrophobicContact CE1-CZ 3.85Å; F135-F149 HydrophobicContact CE2-CE1 4.32Å; F135-F149 HydrophobicContact CE2-CZ 4.22Å; F135-F149 AromaticContact CG-CE1 3.58Å; F135-F149 HydrophobicContact CG-CE1 3.58Å; F135-F149 AromaticContact CG-CZ 3.58Å; F135-F149 HydrophobicContact CG-CZ 3.58Å; F135-F149 HydrophobicContact CZ-CZ 4.16Å; H137-F149 AromaticContact NE2-CD1 3.59Å; H137-F149 AromaticContact NE2-CD2 3.72Å; H137-F149 AromaticContact NE2-CE1 3.88Å; H137-F149 AromaticContact NE2-CE2 3.99Å; H137-F149 AromaticContact NE2-CG 3.55Å; T145-F149 WeakPolarHBondContact O-CB 3.28Å; T145-F149 PolarHBondContact O-N 2.9Å; V147-F149 VanDerWaalsContact C-N 3.34Å; V147-F149 PolarHBondContact O-N 3.19Å; F149-E151 VanDerWaalsContact C-N 3.33Å; F149-E151 PolarHBondContact O-N 3.01Å; F149-E152 HydrophobicContact CD2-CB 4.4Å; F149-E152 PolarHBondContact O-N 2.87Å; F149-Q153 HydrophobicContact CD1-CG 4.31Å; F149-Q153 HydrophobicContact CD2-CG 4.06Å; F149-Q153 HydrophobicContact CE1-CG 3.87Å; F149-Q153 HydrophobicContact CE2-CG 3.59Å; F149-Q153 HydrophobicContact CG-CG 4.38Å; F149-Q153 HydrophobicContact CZ-CG 3.47Å; F149-Q153 VanDerWaalsContact CZ-CG 3.47Å; F149-Q153 WeakPolarHBondContact O-CB 3.06Å; F149-Q153 WeakPolarHBondContact O-CG 3.47Å; F149-Q153 PolarHBondContact O-N 2.9Å
150	A	98.3	Very high	97	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-40.7	171.4	0	0	0	0	0	112	F49 L146 V147 K154 A155 I158	F49-A150 HydrophobicContact CD1-CB 3.97Å; F49-A150 HydrophobicContact CD2-CB 4.2Å; F49-A150 HydrophobicContact CE1-CB 3.95Å; F49-A150 HydrophobicContact CE2-CB 4.17Å; F49-A150 HydrophobicContact CG-CB 4.07Å; F49-A150 HydrophobicContact CZ-CB 4.04Å; L146-A150 VanDerWaalsContact O-CB 3.24Å; L146-A150 WeakPolarHBondContact O-CB 3.07Å; L146-A150 PolarHBondContact O-N 3.09Å; V147-A150 PolarHBondContact O-N 2.95Å; A150-K154 PolarHBondContact O-N 2.75Å; A150-A155 HydrophobicContact CB-CB 4.15Å; A150-A155 WeakPolarHBondContact O-CB 3.47Å; A150-A155 PolarHBondContact O-N 3.04Å; A150-I158 HydrophobicContact CB-CD1 3.69Å; A150-I158 HydrophobicContact CB-CG1 4.07Å
151	E	97.9	Very high	97.3	Very high	75 Å²	75	41.2 Å²	41.2	35%	0.35	20%	0.2	S	C	.	.	H	α-helix	trans	-64.6	-44.9	173.3	-69.7	-173.2	156.3	0	0	111.6	V147 K148 F149 Q153 K154 K185	V147-E151 PolarHBondContact O-N 3.33Å; K148-E151 PolarHBondContact O-N 3.28Å; F149-E151 VanDerWaalsContact C-N 3.33Å; F149-E151 PolarHBondContact O-N 3.01Å; E151-Q153 PolarHBondContact O-N 2.97Å; E151-K154 PolarHBondContact O-N 3.36Å; E151-K185 WeakPolarHBondContact OE1-CD 3.38Å; E151-K185 WeakPolarHBondContact OE1-CE 2.95Å; E151-K185 IonicContact OE1-NZ 2.79Å; E151-K185 PolarHBondContact OE1-NZ 2.87Å; E151-K185 IonicContact OE2-NZ 2.8Å
152	E	97.4	Very high	97.2	Very high	91 Å²	91	34.6 Å²	34.6	43%	0.425	17%	0.172	S	C	.	.	H	α-helix	trans	-62.9	-39	178.9	-73.6	171.3	178.3	0	0	113	K148 F149 K154	K148-E152 WeakPolarHBondContact CE-OE1 3.05Å; K148-E152 IonicContact NZ-OE1 3.87Å; K148-E152 PolarHBondContact NZ-OE1 3.02Å; K148-E152 WeakPolarHBondContact O-CG 3.47Å; K148-E152 PolarHBondContact O-N 3.31Å; F149-E152 HydrophobicContact CD2-CB 4.4Å; F149-E152 PolarHBondContact O-N 2.87Å; E152-K154 PolarHBondContact O-N 2.93Å
153	Q	95.2	Very high	96.9	Very high	52 Å²	52	36.2 Å²	36.2	24%	0.243	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1	174.9	-64.2	-50.3	-68.6	0	0	113.3	F49 H77 F149 E151 A155	F49-Q153 HydrophobicContact CE2-CG 4.45Å; H77-Q153 PolarHBondContact CE1-OE1 2.73Å; H77-Q153 VanDerWaalsContact CE1-OE1 3.3Å; F149-Q153 HydrophobicContact CD1-CG 4.31Å; F149-Q153 HydrophobicContact CD2-CG 4.06Å; F149-Q153 HydrophobicContact CE1-CG 3.87Å; F149-Q153 HydrophobicContact CE2-CG 3.59Å; F149-Q153 HydrophobicContact CG-CG 4.38Å; F149-Q153 HydrophobicContact CZ-CG 3.47Å; F149-Q153 VanDerWaalsContact CZ-CG 3.47Å; F149-Q153 WeakPolarHBondContact O-CB 3.06Å; F149-Q153 WeakPolarHBondContact O-CG 3.47Å; F149-Q153 PolarHBondContact O-N 2.9Å; E151-Q153 PolarHBondContact O-N 2.97Å; Q153-A155 PolarHBondContact O-N 3.29Å
154	K	95.6	Very high	96.4	Very high	171 Å²	171	37.1 Å²	37.1	74%	0.743	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	44.9	-175.5	-56.6	-179.5	-179.5	-179.9	0	111.6	A150 E151 E152 D156	A150-K154 PolarHBondContact O-N 2.75Å; E151-K154 PolarHBondContact O-N 3.36Å; E152-K154 PolarHBondContact O-N 2.93Å; K154-D156 PolarHBondContact O-N 3.23Å
155	A	97.1	Very high	95.7	Very high	8 Å²	8	39.7 Å²	39.7	7%	0.066	20%	0.195	C	C	.	.			trans	-59.8	131.6	179.6	0	0	0	0	0	110.7	F49 A150 Q153 T186	F49-A155 HydrophobicContact CB-CB 3.65Å; F49-A155 HydrophobicContact CD2-CB 4.35Å; F49-A155 HydrophobicContact CG-CB 4.26Å; A150-A155 HydrophobicContact CB-CB 4.15Å; A150-A155 WeakPolarHBondContact O-CB 3.47Å; A150-A155 PolarHBondContact O-N 3.04Å; Q153-A155 PolarHBondContact O-N 3.29Å; A155-T186 HydrophobicContact CB-CG2 4.14Å; A155-T186 WeakPolarHBondContact O-CG2 3.33Å; A155-T186 PolarHBondContact O-OG1 3.35Å
156	D	97	Very high	94.6	Very high	50 Å²	50	40.6 Å²	40.6	27%	0.267	21%	0.209	S	C	.	.	S	Bend	trans	-81.6	-29.7	175.5	-65.2	-64	0	0	0	111.5	M38 K46 V47 K154 P187	M38-D156 HydrophobicContact CE-CB 4.36Å; K46-D156 VanDerWaalsContact CA-OD2 3.27Å; K46-D156 WeakPolarHBondContact CA-OD2 3.35Å; K46-D156 HydrophobicContact CB-CB 4.35Å; V47-D156 PolarHBondContact N-OD2 3.04Å; V47-D156 PolarHBondContact O-N 2.94Å; K154-D156 PolarHBondContact O-N 3.23Å; D156-P187 WeakPolarHBondContact O-CD 3.37Å
157	I	98	Very high	93	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.041	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	140.1	178	-163.2	170.5	0	0	0	111.3	M38 V47 V48 F49 L69 I159 P187 V189	M38-I157 HydrophobicContact CE-CB 4.34Å; V47-I157 PolarHBondContact O-N 3.31Å; V48-I157 HydrophobicContact CB-CG2 4.25Å; V48-I157 HydrophobicContact CG1-CG2 4.07Å; V48-I157 HydrophobicContact CG2-CG2 3.95Å; F49-I157 PolarHBondContact N-O 2.83Å; L69-I157 HydrophobicContact CD2-CD1 3.61Å; L69-I157 HydrophobicContact CD2-CG2 4.25Å; I157-I159 HydrophobicContact CG1-CG1 4.47Å; I157-I159 HydrophobicContact CG2-CG1 4.47Å; I157-P187 WeakPolarHBondContact CA-O 3.48Å; I157-P187 HydrophobicContact CG1-CB 4.42Å; I157-V189 HydrophobicContact CD1-CG2 3.39Å; I157-V189 HydrophobicContact CG1-CG2 3.89Å
158	I	98.7	Very high	91.8	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.1	168.7	-58.8	171.8	0	0	0	108.4	F49 P51 A150 V180 T184 T186 P187 L188 V189	F49-I158 HydrophobicContact CB-CG1 4.2Å; F49-I158 HydrophobicContact CD1-CG1 4.18Å; F49-I158 HydrophobicContact CD1-CG2 4.31Å; F49-I158 CarbonylContact O-C 3.58Å; F49-I158 WeakPolarHBondContact O-CA 3.48Å; P51-I158 HydrophobicContact CG-CG2 4.15Å; A150-I158 HydrophobicContact CB-CD1 3.69Å; A150-I158 HydrophobicContact CB-CG1 4.07Å; I158-V180 HydrophobicContact CD1-CG1 4.12Å; I158-T184 WeakPolarHBondContact CD1-OG1 3.4Å; I158-T186 HydrophobicContact CD1-CG2 4.33Å; I158-T186 HydrophobicContact CG1-CG2 3.86Å; I158-P187 PolarHBondContact N-O 2.87Å; I158-L188 HydrophobicContact CB-CD1 3.68Å; I158-L188 HydrophobicContact CG2-CD1 3.5Å; I158-L188 VanDerWaalsContact CG2-CD1 3.5Å; I158-L188 WeakPolarHBondContact O-CA 3.34Å; I158-V189 PolarHBondContact O-N 2.91Å
159	I	98.7	Very high	90.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.7	173.5	-54.5	174.6	0	0	0	107.8	V48 F49 L50 P51 A61 W64 Y65 L69 I157 V189 I191	V48-I159 HydrophobicContact CG1-CD1 3.55Å; V48-I159 HydrophobicContact CG1-CG1 4.13Å; F49-I159 PolarHBondContact O-N 2.89Å; L50-I159 HydrophobicContact CD2-CB 3.96Å; L50-I159 HydrophobicContact CD2-CG2 4.06Å; L50-I159 WeakPolarHBondContact CD2-O 3.2Å; L50-I159 HydrophobicContact CG-CB 4.08Å; P51-I159 WeakPolarHBondContact CD-O 3.49Å; A61-I159 HydrophobicContact CB-CG2 4.32Å; W64-I159 HydrophobicContact CE3-CG2 4.41Å; W64-I159 HydrophobicContact CZ3-CD1 4.48Å; Y65-I159 HydrophobicContact CD2-CD1 3.57Å; Y65-I159 HydrophobicContact CG-CD1 4.01Å; L69-I159 HydrophobicContact CD2-CD1 3.73Å; I157-I159 HydrophobicContact CG1-CG1 4.47Å; I157-I159 HydrophobicContact CG2-CG1 4.47Å; I159-V189 WeakPolarHBondContact CA-O 3.26Å; I159-V189 HydrophobicContact CG1-CB 4.46Å; I159-I191 HydrophobicContact CG2-CD1 4.04Å; I159-I191 HydrophobicContact CG2-CG1 3.84Å
160	I	98.2	Very high	89	Confident	8 Å²	8	69.1 Å²	69.1	4%	0.041	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	152.1	-173.1	-163.1	174.6	0	0	0	111.8	P51 T177 L188 V189 V190 I191	P51-I160 HydrophobicContact CB-CD1 3.92Å; P51-I160 HydrophobicContact CB-CG1 4.09Å; P51-I160 HydrophobicContact CG-CB 4.48Å; P51-I160 HydrophobicContact CG-CD1 3.95Å; P51-I160 HydrophobicContact CG-CG1 4.18Å; I160-T177 HydrophobicContact CG2-CG2 3.82Å; I160-L188 HydrophobicContact CG2-CD1 3.7Å; I160-V189 PolarHBondContact N-O 3.24Å; I160-V190 HydrophobicContact CG2-CG2 4.07Å; I160-V190 WeakPolarHBondContact O-CA 3.37Å; I160-I191 PolarHBondContact O-N 3.04Å
161	G	95.7	Very high	87.6	Confident	2 Å²	2	72.2 Å²	72.2	2%	0.021	35%	0.35	C	S	.	.			trans	-66.3	160.8	165.7	0	0	0	0	0	112.2	R163 T177	G161-R163 VanDerWaalsContact C-N 3.27Å; G161-R163 PolarHBondContact O-N 2.88Å; G161-T177 WeakPolarHBondContact O-CG2 3.46Å; G161-T177 PolarHBondContact O-OG1 3.43Å
162	P	92.4	Very high	86.5	Confident	7 Å²	7	76 Å²	76	5%	0.045	37%	0.372	C	S	.	.	S	Bend	trans	-75.7	-23.8	179.1	27	-16.9	0	0	0	111	L173 G174 T177 V190 I191	P162-L173 HydrophobicContact CB-CD1 4.43Å; P162-L173 CarbonylContact O-C 3.46Å; P162-L173 WeakPolarHBondContact O-CA 3.46Å; P162-G174 PolarHBondContact O-N 3.3Å; P162-T177 PolarHBondContact O-OG1 3.47Å; P162-V190 HydrophobicContact CB-CG1 3.91Å; P162-I191 WeakPolarHBondContact CD-O 3.42Å; P162-I191 VanDerWaalsContact CG-O 3.3Å; P162-I191 WeakPolarHBondContact CG-O 3.31Å
163	R	87.9	Confident	86	Confident	55 Å²	55	74.2 Å²	74.2	21%	0.208	37%	0.365	C	S	.	.			trans	-154.3	157.4	177.7	64.3	-175.3	-68.8	-174.2	2.1	109.3	H57 G161 G166 I168	H57-R163 WeakPolarHBondContact CB-O 3.47Å; H57-R163 WeakPolarHBondContact CD2-CG 2.95Å; H57-R163 PolarHBondContact CD2-O 3.11Å; H57-R163 VanDerWaalsContact CD2-O 3.29Å; H57-R163 VanDerWaalsContact NE2-CG 3.32Å; H57-R163 WeakPolarHBondContact NE2-CG 3.42Å; G161-R163 VanDerWaalsContact C-N 3.27Å; G161-R163 PolarHBondContact O-N 2.88Å; R163-G166 PolarHBondContact NH2-O 3.01Å; R163-I168 PolarHBondContact NH2-O 3.11Å
164	G	86.2	Confident	85.9	Confident	25 Å²	25	72.4 Å²	72.4	26%	0.258	36%	0.36	S	S	.	.			trans	-106.1	-144.2	171	0	0	0	0	0	112	D53 G166	D53-G164 WeakPolarHBondContact OD2-CA 3.45Å; G164-G166 PolarHBondContact O-N 2.9Å
165	L	83.2	Confident	85.7	Confident	106 Å²	106	69.1 Å²	69.1	56%	0.555	36%	0.358	S	S	*	.	S	Bend	trans	-70	15.2	178.4	-60.3	172.3	0	0	0	115.8	D53 A54	D53-L165 PolarHBondContact OD2-N 2.83Å; A54-L165 HydrophobicContact CB-CD1 4.05Å; A54-L165 HydrophobicContact CB-CD2 4.45Å
166	G	74.7	Confident	85.6	Confident	43 Å²	43	70.4 Å²	70.4	44%	0.443	37%	0.366	S	S	.	.			trans	-67.9	139.9	-177.1	0	0	0	0	0	113.6	R163 G164 I168	R163-G166 PolarHBondContact NH2-O 3.01Å; G164-G166 PolarHBondContact O-N 2.9Å; G166-I168 PolarHBondContact O-N 3.01Å
167	L	66.2	Low	85.5	Confident	167 Å²	167	68.3 Å²	68.3	87%	0.874	35%	0.354	S	S	*	.	S	Bend	trans	-73.5	-20.4	-174.7	-64.4	174	0	0	0	114.8	R169	L167-R169 PolarHBondContact O-N 3.45Å
168	I	72.9	Confident	85.4	Confident	119 Å²	119	71.2 Å²	71.2	61%	0.61	37%	0.37	S	S	*	.			trans	-75.7	96.3	-175.2	-54.5	175.4	0	0	0	109.1	R163 G166 R170 T171	R163-I168 PolarHBondContact NH2-O 3.11Å; G166-I168 PolarHBondContact O-N 3.01Å; I168-R170 VanDerWaalsContact C-N 3.28Å; I168-R170 PolarHBondContact O-N 3.35Å; I168-T171 HydrophobicContact CG2-CG2 3.95Å
169	R	66.5	Low	85.4	Confident	224 Å²	224	74.9 Å²	74.9	85%	0.845	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.4	-177.4	-66.2	-175	-179.7	173.4	0.1	114	L167	L167-R169 PolarHBondContact O-N 3.45Å
170	R	70.9	Confident	85.4	Confident	239 Å²	239	75 Å²	75	90%	0.902	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.3	-173.1	-161.8	164	-173.2	159.8	1.3	114	I168	I168-R170 VanDerWaalsContact C-N 3.28Å; I168-R170 PolarHBondContact O-N 3.35Å
171	T	68.8	Low	85.3	Confident	64 Å²	64	78.7 Å²	78.7	39%	0.393	40%	0.403	S	S	.	.			trans	-94.5	135.5	178.4	61.2	0	0	0	0	111.1	I168 L173	I168-T171 HydrophobicContact CG2-CG2 3.95Å; T171-L173 WeakPolarHBondContact CB-O 3.49Å; T171-L173 PolarHBondContact OG1-O 3.07Å
172	L	75.1	Confident	85.4	Confident	155 Å²	155	84.5 Å²	84.5	81%	0.812	43%	0.429	S	S	*	.	S	Bend	trans	-73.4	-32	171.8	-65.8	174	0	0	0	111.5
173	L	87.9	Confident	85.7	Confident	53 Å²	53	88.6 Å²	88.6	28%	0.277	45%	0.448	S	S	.	.	S	Bend	trans	-113.8	129.9	-178.4	-160.2	66.6	0	0	0	110.6	P162 T171 T177 N178 M181 V190	P162-L173 HydrophobicContact CB-CD1 4.43Å; P162-L173 CarbonylContact O-C 3.46Å; P162-L173 WeakPolarHBondContact O-CA 3.46Å; T171-L173 WeakPolarHBondContact CB-O 3.49Å; T171-L173 PolarHBondContact OG1-O 3.07Å; L173-T177 HydrophobicContact CD1-CG2 3.57Å; L173-T177 HydrophobicContact CG-CG2 4.41Å; L173-N178 HydrophobicContact CD2-CB 3.86Å; L173-N178 HydrophobicContact CG-CB 4.2Å; L173-M181 HydrophobicContact CD2-CE 3.79Å; L173-M181 HydrophobicContact CD2-SD 4.25Å; L173-V190 HydrophobicContact CD1-CG1 4.29Å
174	G	91.3	Very high	86.2	Confident	14 Å²	14	87.3 Å²	87.3	14%	0.144	45%	0.446	C	S	.	.			trans	-79	154.4	176.6	0	0	0	0	0	112	P162 V176 T177 N178	P162-G174 PolarHBondContact O-N 3.3Å; G174-V176 VanDerWaalsContact C-N 3.26Å; G174-V176 PolarHBondContact O-N 3.34Å; G174-T177 PolarHBondContact O-N 2.96Å; G174-N178 WeakPolarHBondContact O-CB 3.26Å; G174-N178 PolarHBondContact O-N 2.79Å
175	S	92.1	Very high	86.7	Confident	102 Å²	102	93.8 Å²	93.8	71%	0.713	47%	0.467	S	S	*	.	H	α-helix	trans	-57.9	-36.7	-176.7	57.6	0	0	0	0	113.5	Y179	S175-Y179 WeakPolarHBondContact O-CB 3.29Å; S175-Y179 PolarHBondContact O-N 3.05Å
176	V	95.3	Very high	87.3	Confident	36 Å²	36	89.5 Å²	89.5	22%	0.218	45%	0.445	C	S	.	.	H	α-helix	trans	-66.9	-51.9	177.8	-178	0	0	0	0	110.9	P142 L146 G174 N178 Y179 V180	P142-V176 HydrophobicContact CB-CG1 3.95Å; P142-V176 HydrophobicContact CB-CG2 3.8Å; P142-V176 HydrophobicContact CG-CG2 4.37Å; L146-V176 HydrophobicContact CD1-CG1 3.6Å; G174-V176 VanDerWaalsContact C-N 3.26Å; G174-V176 PolarHBondContact O-N 3.34Å; V176-N178 VanDerWaalsContact C-N 3.3Å; V176-N178 PolarHBondContact O-N 3.4Å; V176-Y179 WeakPolarHBondContact O-CB 3.06Å; V176-Y179 PolarHBondContact O-N 3.29Å; V176-Y179 VanDerWaalsContact O-N 3.14Å; V176-V180 HydrophobicContact CG1-CG2 4.49Å; V176-V180 WeakPolarHBondContact O-CG2 3.22Å; V176-V180 PolarHBondContact O-N 3.26Å
177	T	95.6	Very high	88.4	Confident	5 Å²	5	89.6 Å²	89.6	3%	0.031	44%	0.438	C	S	.	.	H	α-helix	trans	-61.3	-41.5	178.1	-51.4	0	0	0	0	111.2	I160 G161 P162 L173 G174 Y179 V180 M181 V190	I160-T177 HydrophobicContact CG2-CG2 3.82Å; G161-T177 WeakPolarHBondContact O-CG2 3.46Å; G161-T177 PolarHBondContact O-OG1 3.43Å; P162-T177 PolarHBondContact O-OG1 3.47Å; L173-T177 HydrophobicContact CD1-CG2 3.57Å; L173-T177 HydrophobicContact CG-CG2 4.41Å; G174-T177 PolarHBondContact O-N 2.96Å; T177-Y179 VanDerWaalsContact C-N 3.34Å; T177-Y179 PolarHBondContact O-N 3.42Å; T177-V180 PolarHBondContact O-N 3.27Å; T177-M181 VanDerWaalsContact O-CB 3.29Å; T177-M181 WeakPolarHBondContact O-CB 3.23Å; T177-M181 PolarHBondContact O-N 3Å; T177-V190 HydrophobicContact CG2-CG1 3.95Å; T177-V190 HydrophobicContact CG2-CG2 3.77Å
178	N	95.5	Very high	90	Very high	69 Å²	69	83.9 Å²	83.9	37%	0.369	41%	0.408	S	S	.	.	H	α-helix	trans	-60.7	-42.9	174.8	-169.8	63.3	0	0	0	111.9	L173 G174 V176 H182	L173-N178 HydrophobicContact CD2-CB 3.86Å; L173-N178 HydrophobicContact CG-CB 4.2Å; G174-N178 WeakPolarHBondContact O-CB 3.26Å; G174-N178 PolarHBondContact O-N 2.79Å; V176-N178 VanDerWaalsContact C-N 3.3Å; V176-N178 PolarHBondContact O-N 3.4Å; N178-H182 PolarHBondContact O-N 3.15Å; N178-H182 PolarHBondContact O-ND1 2.73Å; N178-H182 PolarHBondContact OD1-CE1 2.94Å; N178-H182 VanDerWaalsContact OD1-CE1 3.24Å
179	Y	97.8	Very high	91.2	Very high	80 Å²	80	80 Å²	80	31%	0.314	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-51.3	175.9	-172.6	-81.3	0	0	0	111.2	G143 P144 V147 S175 V176 T177 M181 H182 H183	G143-Y179 VanDerWaalsContact C-CE1 3.43Å; G143-Y179 VanDerWaalsContact CA-CD1 3.46Å; P144-Y179 HydrophobicContact CB-CE1 4.28Å; P144-Y179 HydrophobicContact CG-CE1 3.9Å; P144-Y179 HydrophobicContact CG-CE2 4.21Å; P144-Y179 VanDerWaalsContact N-CE1 3.32Å; V147-Y179 HydrophobicContact CG2-CD1 4.15Å; V147-Y179 HydrophobicContact CG2-CE1 4.09Å; S175-Y179 WeakPolarHBondContact O-CB 3.29Å; S175-Y179 PolarHBondContact O-N 3.05Å; V176-Y179 WeakPolarHBondContact O-CB 3.06Å; V176-Y179 PolarHBondContact O-N 3.29Å; V176-Y179 VanDerWaalsContact O-N 3.14Å; T177-Y179 VanDerWaalsContact C-N 3.34Å; T177-Y179 PolarHBondContact O-N 3.42Å; Y179-M181 VanDerWaalsContact C-N 3.29Å; Y179-M181 PolarHBondContact O-N 3.18Å; Y179-H182 PolarHBondContact O-N 3.2Å; Y179-H182 VanDerWaalsContact O-N 3.15Å; Y179-H183 HydrophobicContact CD1-CB 4.43Å; Y179-H183 AromaticContact CD1-ND1 3.82Å; Y179-H183 AromaticContact CD2-CE1 3.72Å; Y179-H183 AromaticContact CD2-ND1 3.87Å; Y179-H183 HydrophobicContact CE1-CB 4.03Å; Y179-H183 AromaticContact CE1-CG 3.82Å; Y179-H183 AromaticContact CE1-ND1 3.8Å; Y179-H183 AromaticContact CE2-CE1 3.55Å; Y179-H183 AromaticContact CE2-ND1 3.84Å; Y179-H183 AromaticContact CE2-NE2 3.84Å; Y179-H183 AromaticContact CG-ND1 3.85Å; Y179-H183 AromaticContact CZ-CD2 3.94Å; Y179-H183 AromaticContact CZ-CE1 3.86Å; Y179-H183 AromaticContact CZ-CG 3.86Å; Y179-H183 AromaticContact CZ-ND1 3.8Å; Y179-H183 AromaticContact CZ-NE2 3.93Å; Y179-H183 PolarHBondContact O-N 3.34Å; Y179-H183 PolarHBondContact O-ND1 3.23Å
180	V	98.3	Very high	92.7	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.006	36%	0.363	C	S	.	.	H	α-helix	trans	-56.8	-46	179.7	175.1	0	0	0	0	110.3	L146 V147 I158 V176 T177 H182 H183 T184 L188	L146-V180 HydrophobicContact CB-CG2 4.1Å; L146-V180 HydrophobicContact CD1-CG2 4.28Å; V147-V180 HydrophobicContact CG2-CB 4.41Å; V147-V180 HydrophobicContact CG2-CG1 4.48Å; V147-V180 HydrophobicContact CG2-CG2 4.21Å; I158-V180 HydrophobicContact CD1-CG1 4.12Å; V176-V180 HydrophobicContact CG1-CG2 4.49Å; V176-V180 WeakPolarHBondContact O-CG2 3.22Å; V176-V180 PolarHBondContact O-N 3.26Å; T177-V180 PolarHBondContact O-N 3.27Å; V180-H182 VanDerWaalsContact C-N 3.27Å; V180-H182 PolarHBondContact O-N 3.42Å; V180-H183 PolarHBondContact O-N 3.05Å; V180-T184 HydrophobicContact CG1-CG2 4.31Å; V180-T184 VanDerWaalsContact O-CB 3.27Å; V180-T184 WeakPolarHBondContact O-CB 3.07Å; V180-T184 WeakPolarHBondContact O-CG2 2.99Å; V180-T184 PolarHBondContact O-N 2.72Å; V180-L188 HydrophobicContact CG1-CD1 4.06Å; V180-L188 HydrophobicContact CG1-CD2 4.28Å
181	M	97.2	Very high	93.9	Very high	87 Å²	87	60.4 Å²	60.4	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-56	-36.7	178.8	-175.8	178.4	72.7	0	0	113.9	L173 T177 Y179 L188	L173-M181 HydrophobicContact CD2-CE 3.79Å; L173-M181 HydrophobicContact CD2-SD 4.25Å; T177-M181 VanDerWaalsContact O-CB 3.29Å; T177-M181 WeakPolarHBondContact O-CB 3.23Å; T177-M181 PolarHBondContact O-N 3Å; Y179-M181 VanDerWaalsContact C-N 3.29Å; Y179-M181 PolarHBondContact O-N 3.18Å; M181-L188 HydrophobicContact CB-CD2 3.76Å; M181-L188 HydrophobicContact CG-CD2 4.2Å
182	H	98	Very high	95	Very high	123 Å²	123	61.4 Å²	61.4	57%	0.569	33%	0.329	S	S	*	.	H	α-helix	trans	-87.8	-16.2	-178	-71.8	88.2	0	0	0	114.2	N178 Y179 V180	N178-H182 PolarHBondContact O-N 3.15Å; N178-H182 PolarHBondContact O-ND1 2.73Å; N178-H182 PolarHBondContact OD1-CE1 2.94Å; N178-H182 VanDerWaalsContact OD1-CE1 3.24Å; Y179-H182 PolarHBondContact O-N 3.2Å; Y179-H182 VanDerWaalsContact O-N 3.15Å; V180-H182 VanDerWaalsContact C-N 3.27Å; V180-H182 PolarHBondContact O-N 3.42Å
183	H	98.6	Very high	95.5	Very high	94 Å²	94	56.9 Å²	56.9	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-122.1	-16.4	-170	-60.7	83.1	0	0	0	114	V147 Y179 V180	V147-H183 HydrophobicContact CG1-CB 4.23Å; V147-H183 HydrophobicContact CG2-CB 4.03Å; Y179-H183 HydrophobicContact CD1-CB 4.43Å; Y179-H183 AromaticContact CD1-ND1 3.82Å; Y179-H183 AromaticContact CD2-CE1 3.72Å; Y179-H183 AromaticContact CD2-ND1 3.87Å; Y179-H183 HydrophobicContact CE1-CB 4.03Å; Y179-H183 AromaticContact CE1-CG 3.82Å; Y179-H183 AromaticContact CE1-ND1 3.8Å; Y179-H183 AromaticContact CE2-CE1 3.55Å; Y179-H183 AromaticContact CE2-ND1 3.84Å; Y179-H183 AromaticContact CE2-NE2 3.84Å; Y179-H183 AromaticContact CG-ND1 3.85Å; Y179-H183 AromaticContact CZ-CD2 3.94Å; Y179-H183 AromaticContact CZ-CE1 3.86Å; Y179-H183 AromaticContact CZ-CG 3.86Å; Y179-H183 AromaticContact CZ-ND1 3.8Å; Y179-H183 AromaticContact CZ-NE2 3.93Å; Y179-H183 PolarHBondContact O-N 3.34Å; Y179-H183 PolarHBondContact O-ND1 3.23Å; V180-H183 PolarHBondContact O-N 3.05Å
184	T	98.1	Very high	95.3	Very high	28 Å²	28	58.9 Å²	58.9	17%	0.172	33%	0.325	C	S	.	.			trans	-71.5	138.9	177.9	-172.5	0	0	0	0	111.8	I158 V180 T186 L188	I158-T184 WeakPolarHBondContact CD1-OG1 3.4Å; V180-T184 HydrophobicContact CG1-CG2 4.31Å; V180-T184 VanDerWaalsContact O-CB 3.27Å; V180-T184 WeakPolarHBondContact O-CB 3.07Å; V180-T184 WeakPolarHBondContact O-CG2 2.99Å; V180-T184 PolarHBondContact O-N 2.72Å; T184-T186 VanDerWaalsContact CG2-O 3.31Å; T184-T186 WeakPolarHBondContact CG2-O 3.02Å; T184-T186 PolarHBondContact OG1-N 3.17Å; T184-T186 PolarHBondContact OG1-O 2.85Å; T184-T186 VanDerWaalsContact OG1-O 3.09Å; T184-L188 HydrophobicContact CG2-CB 4.18Å; T184-L188 HydrophobicContact CG2-CD2 4.49Å
185	K	96.5	Very high	94.6	Very high	160 Å²	160	65.1 Å²	65.1	70%	0.696	36%	0.36	S	S	*	.			trans	-92.5	-16	164.5	-60.8	178.8	-161.5	126.4	0	112.2	E151	E151-K185 WeakPolarHBondContact OE1-CD 3.38Å; E151-K185 WeakPolarHBondContact OE1-CE 2.95Å; E151-K185 IonicContact OE1-NZ 2.79Å; E151-K185 PolarHBondContact OE1-NZ 2.87Å; E151-K185 IonicContact OE2-NZ 2.8Å
186	T	96.9	Very high	93.1	Very high	16 Å²	16	74.9 Å²	74.9	10%	0.098	38%	0.381	C	S	.	.	S	Bend	trans	-79	136	176.9	-59.1	0	0	0	0	110.1	A155 I158 T184 L188	A155-T186 HydrophobicContact CB-CG2 4.14Å; A155-T186 WeakPolarHBondContact O-CG2 3.33Å; A155-T186 PolarHBondContact O-OG1 3.35Å; I158-T186 HydrophobicContact CD1-CG2 4.33Å; I158-T186 HydrophobicContact CG1-CG2 3.86Å; T184-T186 VanDerWaalsContact CG2-O 3.31Å; T184-T186 WeakPolarHBondContact CG2-O 3.02Å; T184-T186 PolarHBondContact OG1-N 3.17Å; T184-T186 PolarHBondContact OG1-O 2.85Å; T184-T186 VanDerWaalsContact OG1-O 3.09Å; T186-L188 PolarHBondContact O-N 2.96Å
187	P	97.9	Very high	93	Very high	46 Å²	46	76.9 Å²	76.9	30%	0.299	39%	0.39	S	S	.	.			trans	-45.6	132.2	170.7	-30.2	35.9	0	0	0	112.7	D156 I157 I158	D156-P187 WeakPolarHBondContact O-CD 3.37Å; I157-P187 WeakPolarHBondContact CA-O 3.48Å; I157-P187 HydrophobicContact CG1-CB 4.42Å; I158-P187 PolarHBondContact N-O 2.87Å
188	L	98.1	Very high	92.9	Very high	46 Å²	46	80.6 Å²	80.6	24%	0.241	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130.6	-174.7	179.1	67.1	0	0	0	111	I158 I160 V180 M181 T184 T186 V190	I158-L188 HydrophobicContact CB-CD1 3.68Å; I158-L188 HydrophobicContact CG2-CD1 3.5Å; I158-L188 VanDerWaalsContact CG2-CD1 3.5Å; I158-L188 WeakPolarHBondContact O-CA 3.34Å; I160-L188 HydrophobicContact CG2-CD1 3.7Å; V180-L188 HydrophobicContact CG1-CD1 4.06Å; V180-L188 HydrophobicContact CG1-CD2 4.28Å; M181-L188 HydrophobicContact CB-CD2 3.76Å; M181-L188 HydrophobicContact CG-CD2 4.2Å; T184-L188 HydrophobicContact CG2-CB 4.18Å; T184-L188 HydrophobicContact CG2-CD2 4.49Å; T186-L188 PolarHBondContact O-N 2.96Å; L188-V190 HydrophobicContact CD2-CG2 3.91Å; L188-V190 HydrophobicContact CG-CG2 4Å
189	V	98.3	Very high	92.7	Very high	37 Å²	37	81.3 Å²	81.3	22%	0.224	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	114.2	169.8	-162.5	0	0	0	0	108.6	W64 I157 I158 I159 I160 I191	W64-V189 HydrophobicContact CH2-CG1 3.99Å; W64-V189 HydrophobicContact CZ3-CG1 4.06Å; I157-V189 HydrophobicContact CD1-CG2 3.39Å; I157-V189 HydrophobicContact CG1-CG2 3.89Å; I158-V189 PolarHBondContact O-N 2.91Å; I159-V189 WeakPolarHBondContact CA-O 3.26Å; I159-V189 HydrophobicContact CG1-CB 4.46Å; I160-V189 PolarHBondContact N-O 3.24Å; V189-I191 HydrophobicContact CB-CD1 4.24Å; V189-I191 HydrophobicContact CG1-CD1 3.47Å; V189-I191 VanDerWaalsContact CG1-CD1 3.47Å
190	V	97.6	Very high	92.4	Very high	48 Å²	48	81.4 Å²	81.4	29%	0.291	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	117.5	173.2	-177.3	0	0	0	0	108	I160 P162 L173 T177 L188 P192	I160-V190 HydrophobicContact CG2-CG2 4.07Å; I160-V190 WeakPolarHBondContact O-CA 3.37Å; P162-V190 HydrophobicContact CB-CG1 3.91Å; L173-V190 HydrophobicContact CD1-CG1 4.29Å; T177-V190 HydrophobicContact CG2-CG1 3.95Å; T177-V190 HydrophobicContact CG2-CG2 3.77Å; L188-V190 HydrophobicContact CD2-CG2 3.91Å; L188-V190 HydrophobicContact CG-CG2 4Å; V190-P192 WeakPolarHBondContact O-CD 3.46Å
191	I	96.5	Very high	92.1	Very high	4 Å²	4	86.4 Å²	86.4	2%	0.021	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-86.5	119.4	-178.8	-46.4	-50.5	0	0	0	107	R60 A61 W64 I159 I160 P162 V189	R60-I191 PolarHBondContact NH2-O 2.84Å; A61-I191 HydrophobicContact CB-CB 4.34Å; A61-I191 HydrophobicContact CB-CG1 3.98Å; W64-I191 HydrophobicContact CB-CD1 4.36Å; W64-I191 HydrophobicContact CB-CG1 4.24Å; W64-I191 HydrophobicContact CB-CG2 3.82Å; W64-I191 HydrophobicContact CD2-CD1 3.48Å; W64-I191 VanDerWaalsContact CD2-CD1 3.48Å; W64-I191 HydrophobicContact CD2-CG1 4.31Å; W64-I191 HydrophobicContact CE3-CD1 3.47Å; W64-I191 VanDerWaalsContact CE3-CD1 3.47Å; W64-I191 HydrophobicContact CE3-CG1 4.33Å; W64-I191 HydrophobicContact CG-CD1 3.87Å; W64-I191 HydrophobicContact CG-CG1 4.27Å; W64-I191 HydrophobicContact CG-CG2 3.89Å; W64-I191 HydrophobicContact CZ3-CD1 4.02Å; I159-I191 HydrophobicContact CG2-CD1 4.04Å; I159-I191 HydrophobicContact CG2-CG1 3.84Å; I160-I191 PolarHBondContact O-N 3.04Å; P162-I191 WeakPolarHBondContact CD-O 3.42Å; P162-I191 VanDerWaalsContact CG-O 3.3Å; P162-I191 WeakPolarHBondContact CG-O 3.31Å; V189-I191 HydrophobicContact CB-CD1 4.24Å; V189-I191 HydrophobicContact CG1-CD1 3.47Å; V189-I191 VanDerWaalsContact CG1-CD1 3.47Å
192	P	91.9	Very high	91.7	Very high	85 Å²	85	86.3 Å²	86.3	55%	0.552	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-81.7	150.1	-176.8	32.5	-35.8	0	0	0	112.3	R60 V190	R60-P192 PolarHBondContact NH1-O 3.35Å; R60-P192 PolarHBondContact NH2-O 2.83Å; V190-P192 WeakPolarHBondContact O-CD 3.46Å
193	P	87.2	Confident	91.3	Very high	60 Å²	60	83.7 Å²	83.7	39%	0.39	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-56.4	159.8	178.7	30.5	-37.1	0	0	0	112.1
194	P	82.4	Confident	90.7	Very high	95 Å²	95	82.9 Å²	82.9	62%	0.617	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-57.2	144.1	174.4	25.9	-33.5	0	0	0	110.5	R196	P194-R196 PolarHBondContact O-N 3.15Å
195	V	77.3	Confident	90.1	Very high	145 Å²	145	87.5 Å²	87.5	88%	0.879	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-63.4	127.9	168.2	-174	0	0	0	0	106.6
196	R	60.5	Low	89.5	Confident	308 Å²	308	80.9 Å²	80.9	100%	1.162	43%	0.434	S	S	*	.			trans	-79.2	0	172.4	-77.2	-174.7	-178.6	174	-1.8	110.3	P194	P194-R196 PolarHBondContact O-N 3.15Å

Retrieved 196 of 196 residues in 62.5 ms (Link to these results)

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