A0A087YA21_POEFO Loading...

S100 calcium binding protein A10b

AlphaFold DB , UniProt , Accession A0A087YA21, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 178 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	34.5	Very low	34.9	Very low	195 Å²	195	90.8 Å²	90.8	96%	0.961	48%	0.479	S	S	*	.				0	129	0	-67.1	-174.6	-79.4	0	0	107.2
2	S	29.3	Very low	34.8	Very low	50 Å²	50	90.9 Å²	90.9	35%	0.35	49%	0.493	S	S	.	.			trans	-67.1	150.8	-172.8	-178.4	0	0	0	0	112.3	A4 L5 K6	S2-A4 PolarHBondContact O-N 3.37Å; S2-A4 VanDerWaalsContact O-N 3.14Å; S2-L5 WeakPolarHBondContact O-CA 3.17Å; S2-L5 WeakPolarHBondContact O-CB 3.03Å; S2-L5 PolarHBondContact O-N 2.62Å; S2-K6 PolarHBondContact O-N 2.65Å
3	V	37.5	Very low	34.6	Very low	30 Å²	30	95.7 Å²	95.7	18%	0.182	51%	0.51	C	S	.	.	H	α-helix	trans	-45.7	-42.9	176	-166.1	0	0	0	0	112.7	L5 K6 I7 D139 L140	V3-L5 PolarHBondContact O-N 2.72Å; V3-K6 PolarHBondContact O-N 3.33Å; V3-I7 HydrophobicContact CG1-CD1 3.84Å; V3-I7 HydrophobicContact CG1-CG1 4.23Å; V3-I7 PolarHBondContact O-N 3.33Å; V3-D139 HydrophobicContact CB-CB 4.31Å; V3-D139 HydrophobicContact CG1-CB 3.93Å; V3-D139 HydrophobicContact CG2-CB 3.83Å; V3-D139 WeakPolarHBondContact CG2-O 3.35Å; V3-L140 HydrophobicContact CG1-CD2 4.07Å; V3-L140 HydrophobicContact CG2-CD2 4.46Å
4	A	33.9	Very low	34.8	Very low	36 Å²	36	99.9 Å²	99.9	30%	0.298	53%	0.531	S	S	.	.	H	α-helix	trans	-58	-34.3	178.4	0	0	0	0	0	112.7	S2 S8	S2-A4 PolarHBondContact O-N 3.37Å; S2-A4 VanDerWaalsContact O-N 3.14Å; A4-S8 VanDerWaalsContact O-CB 3.26Å; A4-S8 WeakPolarHBondContact O-CB 3.24Å; A4-S8 PolarHBondContact O-N 3.05Å; A4-S8 VanDerWaalsContact O-N 3.09Å; A4-S8 PolarHBondContact O-OG 3.33Å
5	L	31	Very low	34.7	Very low	109 Å²	109	97.7 Å²	97.7	57%	0.571	54%	0.541	S	S	*	.	H	α-helix	trans	-73	-34.5	173.3	-90.2	79.6	0	0	0	112.2	S2 V3 S8 F9	S2-L5 WeakPolarHBondContact O-CA 3.17Å; S2-L5 WeakPolarHBondContact O-CB 3.03Å; S2-L5 PolarHBondContact O-N 2.62Å; V3-L5 PolarHBondContact O-N 2.72Å; L5-S8 PolarHBondContact O-N 3.17Å; L5-F9 VanDerWaalsContact O-CB 3.24Å; L5-F9 WeakPolarHBondContact O-CB 3.4Å; L5-F9 PolarHBondContact O-N 3.2Å
6	K	35.3	Very low	34.4	Very low	87 Å²	87	96.4 Å²	96.4	38%	0.378	56%	0.558	S	S	.	*	H	α-helix	trans	-75	-40.1	179	-78.3	179.4	171.9	-176.5	0	113	S2 V3 S8 F9 L10 D139	S2-K6 PolarHBondContact O-N 2.65Å; V3-K6 PolarHBondContact O-N 3.33Å; K6-S8 VanDerWaalsContact C-N 3.29Å; K6-S8 PolarHBondContact O-N 3.08Å; K6-F9 WeakPolarHBondContact O-CB 3.45Å; K6-F9 PolarHBondContact O-N 3.41Å; K6-L10 PolarHBondContact O-N 2.93Å; K6-D139 VanDerWaalsContact CD-OD1 3.23Å; K6-D139 WeakPolarHBondContact CD-OD1 2.86Å; K6-D139 WeakPolarHBondContact CD-OD2 3.3Å; K6-D139 WeakPolarHBondContact CE-OD1 3.34Å; K6-D139 IonicContact NZ-OD1 2.6Å; K6-D139 PolarHBondContact NZ-OD1 3.12Å; K6-D139 IonicContact NZ-OD2 3.52Å
7	I	38.3	Very low	34.7	Very low	82 Å²	82	102.9 Å²	102.9	42%	0.421	58%	0.578	S	S	.	*	H	α-helix	trans	-63.7	-39	170.8	-64.3	176.5	0	0	0	109.8	V3 L11	V3-I7 HydrophobicContact CG1-CD1 3.84Å; V3-I7 HydrophobicContact CG1-CG1 4.23Å; V3-I7 PolarHBondContact O-N 3.33Å; I7-L11 HydrophobicContact CG2-CD1 4.46Å; I7-L11 WeakPolarHBondContact O-CG 3.22Å; I7-L11 PolarHBondContact O-N 3.1Å
8	S	34.8	Very low	34.5	Very low	47 Å²	47	105.7 Å²	105.7	33%	0.329	59%	0.591	S	S	.	*	H	α-helix	trans	-64.4	-40.7	171.4	-59.4	0	0	0	0	112.5	A4 L5 K6 L10 L11 S12	A4-S8 VanDerWaalsContact O-CB 3.26Å; A4-S8 WeakPolarHBondContact O-CB 3.24Å; A4-S8 PolarHBondContact O-N 3.05Å; A4-S8 VanDerWaalsContact O-N 3.09Å; A4-S8 PolarHBondContact O-OG 3.33Å; L5-S8 PolarHBondContact O-N 3.17Å; K6-S8 VanDerWaalsContact C-N 3.29Å; K6-S8 PolarHBondContact O-N 3.08Å; S8-L10 PolarHBondContact O-N 2.93Å; S8-L11 CarbonylContact O-C 3.55Å; S8-L11 PolarHBondContact O-N 2.58Å; S8-L11 VanDerWaalsContact O-N 3.08Å; S8-S12 PolarHBondContact O-N 3.01Å; S8-S12 PolarHBondContact O-OG 3.13Å; S8-S12 VanDerWaalsContact O-OG 3.09Å
9	F	33.8	Very low	34.7	Very low	137 Å²	137	105.6 Å²	105.6	60%	0.601	59%	0.594	S	S	*	*	H	α-helix	trans	-64.1	-39.4	179	-173.1	-97.9	0	0	0	112.5	L5 K6 L11 S12	L5-F9 VanDerWaalsContact O-CB 3.24Å; L5-F9 WeakPolarHBondContact O-CB 3.4Å; L5-F9 PolarHBondContact O-N 3.2Å; K6-F9 WeakPolarHBondContact O-CB 3.45Å; K6-F9 PolarHBondContact O-N 3.41Å; F9-L11 VanDerWaalsContact C-N 3.26Å; F9-L11 PolarHBondContact O-N 3Å; F9-S12 PolarHBondContact O-N 3.13Å
10	L	36.7	Very low	34.7	Very low	131 Å²	131	106.8 Å²	106.8	69%	0.686	60%	0.599	S	S	*	*	H	α-helix	trans	-64	-29.6	171.8	-79.8	165.1	0	0	0	112.9	K6 S8	K6-L10 PolarHBondContact O-N 2.93Å; S8-L10 PolarHBondContact O-N 2.93Å
11	L	38.8	Very low	34.9	Very low	95 Å²	95	111 Å²	111	50%	0.497	61%	0.605	S	S	.	*	H	α-helix	trans	-84.1	-29.8	175.5	-66.4	171.6	0	0	0	112.9	I7 S8 F9 H13 L14	I7-L11 HydrophobicContact CG2-CD1 4.46Å; I7-L11 WeakPolarHBondContact O-CG 3.22Å; I7-L11 PolarHBondContact O-N 3.1Å; S8-L11 CarbonylContact O-C 3.55Å; S8-L11 PolarHBondContact O-N 2.58Å; S8-L11 VanDerWaalsContact O-N 3.08Å; F9-L11 VanDerWaalsContact C-N 3.26Å; F9-L11 PolarHBondContact O-N 3Å; L11-H13 PolarHBondContact O-N 2.92Å; L11-L14 PolarHBondContact O-N 2.59Å
12	S	33.4	Very low	34.9	Very low	92 Å²	92	108 Å²	108	64%	0.643	59%	0.593	S	S	*	*	H	α-helix	trans	-67.8	-19.1	178.9	-66	0	0	0	0	114.1	S8 F9 L14	S8-S12 PolarHBondContact O-N 3.01Å; S8-S12 PolarHBondContact O-OG 3.13Å; S8-S12 VanDerWaalsContact O-OG 3.09Å; F9-S12 PolarHBondContact O-N 3.13Å; S12-L14 VanDerWaalsContact C-N 3.3Å; S12-L14 PolarHBondContact O-N 3.29Å
13	H	33	Very low	35	Very low	153 Å²	153	108.6 Å²	108.6	71%	0.708	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-1.4	-179.3	-116.3	-67.5	0	0	0	115.1	L11	L11-H13 PolarHBondContact O-N 2.92Å
14	L	37.4	Very low	34.6	Very low	154 Å²	154	111.2 Å²	111.2	81%	0.806	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.9	5.3	-178.3	-64.2	176.5	0	0	0	114.3	L11 S12	L11-L14 PolarHBondContact O-N 2.59Å; S12-L14 VanDerWaalsContact C-N 3.3Å; S12-L14 PolarHBondContact O-N 3.29Å
15	G	32.9	Very low	34.4	Very low	67 Å²	67	115.9 Å²	115.9	69%	0.691	66%	0.662	S	S	*	*			trans	-99.4	89.5	-172.8	0	0	0	0	0	115.3
16	G	29.3	Very low	34.2	Very low	78 Å²	78	114.8 Å²	114.8	80%	0.804	66%	0.663	S	S	*	*			trans	-72.8	143.7	166.3	0	0	0	0	0	112.8
17	K	40.7	Very low	34.2	Very low	207 Å²	207	118.7 Å²	118.7	90%	0.9	69%	0.688	S	S	*	*			trans	-70.5	139.3	-175.3	-60.1	169.2	177.5	173.4	0	113.5
18	N	31.3	Very low	33.7	Very low	152 Å²	152	123.1 Å²	123.1	81%	0.813	70%	0.704	S	S	*	*				-157.5	179.6	124.4	-142.8	-21.8	0	0	0	112.8
19	T	38.1	Very low	33.6	Very low	105 Å²	105	124.1 Å²	124.1	64%	0.644	71%	0.711	S	S	*	*			trans	-138.4	156	-148.6	58.9	0	0	0	0	114.5
20	N	34.3	Very low	33.7	Very low	129 Å²	129	124.8 Å²	124.8	69%	0.69	72%	0.719	S	S	*	*			trans	60.8	157.6	165.7	-77.4	-23.7	0	0	0	116
21	R	39.2	Very low	33.7	Very low	195 Å²	195	124 Å²	124	74%	0.736	72%	0.715	S	S	*	*			cis	-164.4	171	-15	-119.1	-172.7	-84.6	162.9	-0.1	106.7
22	D	33.6	Very low	33.5	Very low	133 Å²	133	124.6 Å²	124.6	71%	0.711	73%	0.726	S	S	*	*			cis	-153.6	-169.8	4.9	-143.3	-33.5	0	0	0	110.9
23	G	31.4	Very low	33.4	Very low	62 Å²	62	127.8 Å²	127.8	64%	0.639	74%	0.735	S	S	*	*			trans	13.1	107.4	159.8	0	0	0	0	0	120.5
24	A	30.5	Very low	33.4	Very low	85 Å²	85	130.9 Å²	130.9	70%	0.702	74%	0.741	S	S	*	*				88.1	97.8	68	0	0	0	0	0	116.1
25	S	28.8	Very low	33.1	Very low	134 Å²	134	132.3 Å²	132.3	94%	0.937	74%	0.737	S	S	*	*			trans	-137.4	89	140.3	-87.2	0	0	0	0	107.7
26	C	27.3	Very low	33.1	Very low	86 Å²	86	134.1 Å²	134.1	58%	0.581	74%	0.736	S	S	*	*			trans	-89.6	120.1	-168.8	-66.5	0	0	0	0	111.5
27	N	34.6	Very low	33.5	Very low	168 Å²	168	135.8 Å²	135.8	90%	0.898	73%	0.726	S	S	*	*	S	Bend	trans	-146.2	23.8	157	-117.4	-31.5	0	0	0	114.7
28	F	28.5	Very low	33.3	Very low	176 Å²	176	129.2 Å²	129.2	77%	0.772	71%	0.705	S	S	*	*	S	Bend	trans	-135.2	12.7	169.5	-139.1	-102.6	0	0	0	114	I30	F28-I30 VanDerWaalsContact C-N 3.33Å; F28-I30 PolarHBondContact O-N 2.89Å
29	S	32.3	Very low	33.7	Very low	67 Å²	67	129.9 Å²	129.9	47%	0.469	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88	19	-171.5	-50.4	0	0	0	0	115.2
30	I	35.9	Very low	34	Very low	152 Å²	152	127.6 Å²	127.6	78%	0.779	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	-10.9	-178.4	-67	-175.2	0	0	0	113.9	F28	F28-I30 VanDerWaalsContact C-N 3.33Å; F28-I30 PolarHBondContact O-N 2.89Å
31	L	36.1	Very low	34.1	Very low	114 Å²	114	126.6 Å²	126.6	60%	0.597	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-31.3	170.4	-100.1	75.6	0	0	0	114.8	L33 Y35	L31-L33 PolarHBondContact O-N 3.02Å; L31-Y35 WeakPolarHBondContact O-CD2 3.09Å
32	C	34.6	Very low	34.3	Very low	108 Å²	108	122.4 Å²	122.4	73%	0.73	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-6.1	-174.8	-64.1	0	0	0	0	115.7
33	L	31.2	Very low	34.7	Very low	158 Å²	158	118.2 Å²	118.2	83%	0.827	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	11.4	179.6	-76.3	174.3	0	0	0	114.6	L31	L31-L33 PolarHBondContact O-N 3.02Å
34	R	33	Very low	35.3	Very low	219 Å²	219	120.4 Å²	120.4	83%	0.826	63%	0.63	S	S	*	*	S	Bend	trans	-133.7	7.9	178.4	-143.4	170.4	-175.1	153.9	1.4	116.5	P36	R34-P36 WeakPolarHBondContact O-CD 3.18Å
35	Y	31.1	Very low	35.8	Very low	184 Å²	184	124.4 Å²	124.4	72%	0.722	63%	0.627	S	S	*	*			trans	-107	90.3	167.9	-72.5	-80.2	0	0	0	110.6	L31	L31-Y35 WeakPolarHBondContact O-CD2 3.09Å
36	P	32.9	Very low	36.5	Very low	105 Å²	105	124.7 Å²	124.7	68%	0.682	61%	0.612	S	S	*	*			trans	-55.3	144.5	148.2	29.2	-33.5	0	0	0	107.8	R34 P38	R34-P36 WeakPolarHBondContact O-CD 3.18Å; P36-P38 VanDerWaalsContact O-N 3.17Å
37	L	37.2	Very low	37.2	Very low	113 Å²	113	123.4 Å²	123.4	59%	0.592	60%	0.599	S	S	*	*			trans	-38.6	125	172	-83.6	158.4	0	0	0	109.5	R39	L37-R39 PolarHBondContact O-N 2.89Å
38	P	36.8	Very low	37.8	Very low	69 Å²	69	119 Å²	119	45%	0.448	58%	0.575	S	S	.	*			trans	-55.4	119.6	-175.4	21.8	-32.5	0	0	0	108	P36 H42 V43	P36-P38 VanDerWaalsContact O-N 3.17Å; P38-H42 HydrophobicContact CB-CB 3.7Å; P38-V43 HydrophobicContact CB-CG2 3.82Å; P38-V43 HydrophobicContact CG-CG2 3.63Å
39	R	39.7	Very low	38.6	Very low	166 Å²	166	114.7 Å²	114.7	63%	0.626	56%	0.56	S	S	*	*			trans	-52.9	151.2	172.7	-65	-164.5	-95.6	-149.8	-7.6	107.8	L37 H41 H42 V43	L37-R39 PolarHBondContact O-N 2.89Å; R39-H41 WeakPolarHBondContact CB-CE1 3.36Å; R39-H41 PolarHBondContact O-N 3.28Å; R39-H42 WeakPolarHBondContact O-CA 3.03Å; R39-H42 WeakPolarHBondContact O-CB 3.35Å; R39-H42 PolarHBondContact O-N 3.46Å; R39-V43 PolarHBondContact O-N 3.01Å
40	P	45.7	Very low	38.9	Very low	57 Å²	57	114.1 Å²	114.1	37%	0.37	56%	0.555	S	S	.	*	H	α-helix	trans	-49.6	-32.9	-173.9	11.4	-26.6	0	0	0	114.2	H42 V43 R44	P40-H42 PolarHBondContact O-N 3.27Å; P40-V43 PolarHBondContact O-N 3.19Å; P40-R44 PolarHBondContact O-N 2.72Å
41	H	36.8	Very low	39.6	Very low	108 Å²	108	110 Å²	110	50%	0.5	54%	0.538	S	S	.	.	H	α-helix	trans	-66.2	-27	172.9	58.5	-106.6	0	0	0	116.1	R39 R45	R39-H41 WeakPolarHBondContact CB-CE1 3.36Å; R39-H41 PolarHBondContact O-N 3.28Å; H41-R45 WeakPolarHBondContact O-CB 3.4Å; H41-R45 PolarHBondContact O-N 3.5Å; H41-R45 VanDerWaalsContact O-N 3.09Å
42	H	42.7	Very low	40.2	Very low	106 Å²	106	107.6 Å²	107.6	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-81.1	-30.9	173.5	-81.6	-82.4	0	0	0	112.6	P38 R39 P40 F46	P38-H42 HydrophobicContact CB-CB 3.7Å; R39-H42 WeakPolarHBondContact O-CA 3.03Å; R39-H42 WeakPolarHBondContact O-CB 3.35Å; R39-H42 PolarHBondContact O-N 3.46Å; P40-H42 PolarHBondContact O-N 3.27Å; H42-F46 WeakPolarHBondContact O-CB 3.35Å; H42-F46 PolarHBondContact O-N 3.16Å
43	V	41.7	Very low	40.6	Very low	46 Å²	46	108 Å²	108	28%	0.279	52%	0.524	S	S	.	.	H	α-helix	trans	-67.9	-46.2	170.7	-177.9	0	0	0	0	109.6	P38 R39 P40 R45 F46 L47	P38-V43 HydrophobicContact CB-CG2 3.82Å; P38-V43 HydrophobicContact CG-CG2 3.63Å; R39-V43 PolarHBondContact O-N 3.01Å; P40-V43 PolarHBondContact O-N 3.19Å; V43-R45 PolarHBondContact O-N 3.34Å; V43-F46 PolarHBondContact O-N 3.41Å; V43-L47 HydrophobicContact CG1-CD1 3.97Å; V43-L47 HydrophobicContact CG1-CG 4.44Å; V43-L47 WeakPolarHBondContact O-CG 2.77Å; V43-L47 PolarHBondContact O-N 3.46Å
44	R	44.8	Very low	41.3	Very low	107 Å²	107	107.6 Å²	107.6	40%	0.404	51%	0.513	S	S	.	.	H	α-helix	trans	-50.6	-54.4	171.5	-161.2	98	179	-146	13.7	110.7	P40 F46 L47 D48 E151	P40-R44 PolarHBondContact O-N 2.72Å; R44-F46 PolarHBondContact O-N 2.56Å; R44-L47 CarbonylContact O-C 3.49Å; R44-L47 WeakPolarHBondContact O-CA 3.43Å; R44-L47 WeakPolarHBondContact O-CB 3.15Å; R44-L47 PolarHBondContact O-N 2.84Å; R44-D48 VanDerWaalsContact O-CG 3.29Å; R44-D48 PolarHBondContact O-N 3.3Å; R44-D48 VanDerWaalsContact O-OD2 3.09Å; R44-E151 IonicContact CZ-OE2 2.83Å; R44-E151 IonicContact NE-OE2 2.77Å; R44-E151 PolarHBondContact NE-OE2 3.35Å; R44-E151 IonicContact NH1-OE2 3.75Å; R44-E151 IonicContact NH2-OE2 2.64Å; R44-E151 PolarHBondContact NH2-OE2 3.36Å
45	R	40.1	Very low	41.8	Very low	169 Å²	169	103.7 Å²	103.7	64%	0.638	50%	0.502	S	S	*	.	H	α-helix	trans	-63.5	-36.8	-179.2	-168.7	162.8	-177.3	165.9	1.9	114.4	H41 V43 L47 D48 D49	H41-R45 WeakPolarHBondContact O-CB 3.4Å; H41-R45 PolarHBondContact O-N 3.5Å; H41-R45 VanDerWaalsContact O-N 3.09Å; V43-R45 PolarHBondContact O-N 3.34Å; R45-L47 VanDerWaalsContact C-N 3.35Å; R45-D48 PolarHBondContact O-N 3.36Å; R45-D49 WeakPolarHBondContact O-CB 3.43Å; R45-D49 PolarHBondContact O-N 2.98Å
46	F	43	Very low	42.4	Very low	140 Å²	140	100 Å²	100	61%	0.614	49%	0.494	S	S	*	.	H	α-helix	trans	-65.1	-39.5	172.8	-177.7	-97.5	0	0	0	111.6	H42 V43 R44 C50	H42-F46 WeakPolarHBondContact O-CB 3.35Å; H42-F46 PolarHBondContact O-N 3.16Å; V43-F46 PolarHBondContact O-N 3.41Å; R44-F46 PolarHBondContact O-N 2.56Å; F46-C50 WeakPolarHBondContact O-CB 3.18Å; F46-C50 PolarHBondContact O-N 3.12Å; F46-C50 PolarHBondContact O-SG 2.79Å; F46-C50 VanDerWaalsContact O-SG 3.32Å
47	L	43.3	Very low	42.9	Very low	60 Å²	60	98.2 Å²	98.2	31%	0.314	48%	0.484	S	S	.	.	H	α-helix	trans	-69.3	-35.1	173.7	-68	170	0	0	0	112.5	V43 R44 R45 T51 V154	V43-L47 HydrophobicContact CG1-CD1 3.97Å; V43-L47 HydrophobicContact CG1-CG 4.44Å; V43-L47 WeakPolarHBondContact O-CG 2.77Å; V43-L47 PolarHBondContact O-N 3.46Å; R44-L47 CarbonylContact O-C 3.49Å; R44-L47 WeakPolarHBondContact O-CA 3.43Å; R44-L47 WeakPolarHBondContact O-CB 3.15Å; R44-L47 PolarHBondContact O-N 2.84Å; R45-L47 VanDerWaalsContact C-N 3.35Å; L47-T51 WeakPolarHBondContact O-CB 3.28Å; L47-T51 PolarHBondContact O-N 3.4Å; L47-T51 PolarHBondContact O-OG1 3.32Å; L47-V154 HydrophobicContact CD1-CG1 4.37Å
48	D	45.8	Very low	43	Very low	76 Å²	76	98.4 Å²	98.4	41%	0.406	48%	0.482	S	S	.	.	H	α-helix	trans	-65.9	-44.3	173.7	-69	-47.3	0	0	0	111.4	R44 R45 T51 S52	R44-D48 VanDerWaalsContact O-CG 3.29Å; R44-D48 PolarHBondContact O-N 3.3Å; R44-D48 VanDerWaalsContact O-OD2 3.09Å; R45-D48 PolarHBondContact O-N 3.36Å; D48-T51 PolarHBondContact O-N 2.85Å; D48-S52 WeakPolarHBondContact O-CB 3.4Å; D48-S52 PolarHBondContact O-N 2.84Å; D48-S52 PolarHBondContact O-OG 3.05Å
49	D	45.8	Very low	43	Very low	85 Å²	85	99.3 Å²	99.3	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-64.2	-45.7	175.6	-69.6	-25.3	0	0	0	110	R45 S52 L53	R45-D49 WeakPolarHBondContact O-CB 3.43Å; R45-D49 PolarHBondContact O-N 2.98Å; D49-S52 PolarHBondContact O-N 3.48Å; D49-L53 VanDerWaalsContact O-CG 3.3Å; D49-L53 WeakPolarHBondContact O-CG 3.37Å; D49-L53 PolarHBondContact O-N 3.08Å
50	C	39.2	Very low	42.9	Very low	54 Å²	54	95 Å²	95	37%	0.365	48%	0.482	S	S	.	.	H	α-helix	trans	-63.8	-39	173.7	-75.3	0	0	0	0	113.4	F46 S52 L53 Y54	F46-C50 WeakPolarHBondContact O-CB 3.18Å; F46-C50 PolarHBondContact O-N 3.12Å; F46-C50 PolarHBondContact O-SG 2.79Å; F46-C50 VanDerWaalsContact O-SG 3.32Å; C50-S52 VanDerWaalsContact C-N 3.33Å; C50-L53 PolarHBondContact O-N 3.4Å; C50-Y54 WeakPolarHBondContact O-CB 3.38Å; C50-Y54 PolarHBondContact O-N 2.79Å
51	T	51.1	Low	42.8	Very low	66 Å²	66	97.1 Å²	97.1	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-66.7	-37.5	176.4	-64.1	0	0	0	0	111	L47 D48 Y54 K55	L47-T51 WeakPolarHBondContact O-CB 3.28Å; L47-T51 PolarHBondContact O-N 3.4Å; L47-T51 PolarHBondContact O-OG1 3.32Å; D48-T51 PolarHBondContact O-N 2.85Å; T51-Y54 PolarHBondContact O-N 3.48Å; T51-K55 HydrophobicContact CG2-CD 4.45Å; T51-K55 WeakPolarHBondContact O-CG 3.44Å; T51-K55 PolarHBondContact O-N 3.4Å
52	S	46.9	Very low	42.8	Very low	63 Å²	63	98 Å²	98	44%	0.441	51%	0.511	S	S	.	.	H	α-helix	trans	-66	-42.7	173.3	-59.4	0	0	0	0	111.1	D48 D49 C50 K55 L56	D48-S52 WeakPolarHBondContact O-CB 3.4Å; D48-S52 PolarHBondContact O-N 2.84Å; D48-S52 PolarHBondContact O-OG 3.05Å; D49-S52 PolarHBondContact O-N 3.48Å; C50-S52 VanDerWaalsContact C-N 3.33Å; S52-K55 PolarHBondContact O-N 2.82Å; S52-L56 WeakPolarHBondContact O-CB 3.38Å; S52-L56 VanDerWaalsContact O-CG 3.24Å; S52-L56 WeakPolarHBondContact O-CG 3.43Å; S52-L56 PolarHBondContact O-N 3.09Å
53	L	44.2	Very low	42.6	Very low	116 Å²	116	99.7 Å²	99.7	61%	0.607	52%	0.523	S	S	*	.	H	α-helix	trans	-64	-38.3	174.4	-71.1	168.5	0	0	0	112.9	D49 C50 L56 S57	D49-L53 VanDerWaalsContact O-CG 3.3Å; D49-L53 WeakPolarHBondContact O-CG 3.37Å; D49-L53 PolarHBondContact O-N 3.08Å; C50-L53 PolarHBondContact O-N 3.4Å; L53-L56 PolarHBondContact O-N 2.93Å; L53-S57 PolarHBondContact O-N 3.08Å
54	Y	44.6	Very low	42.8	Very low	151 Å²	151	105 Å²	105	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-70.2	-34.7	175.6	-176.2	-105.9	0	0	0	113	C50 T51 S57 Q58	C50-Y54 WeakPolarHBondContact O-CB 3.38Å; C50-Y54 PolarHBondContact O-N 2.79Å; T51-Y54 PolarHBondContact O-N 3.48Å; Y54-S57 PolarHBondContact O-OG 2.79Å; Y54-S57 VanDerWaalsContact O-OG 3.05Å; Y54-Q58 PolarHBondContact O-N 3.13Å
55	K	45.3	Very low	42.1	Very low	136 Å²	136	105.5 Å²	105.5	59%	0.591	56%	0.563	S	S	*	*	H	α-helix	trans	-67.2	-40.4	169.3	-74.4	173.8	-179.8	173.4	0	111.1	T51 S52 Q58 T59	T51-K55 HydrophobicContact CG2-CD 4.45Å; T51-K55 WeakPolarHBondContact O-CG 3.44Å; T51-K55 PolarHBondContact O-N 3.4Å; S52-K55 PolarHBondContact O-N 2.82Å; K55-Q58 PolarHBondContact O-N 2.91Å; K55-T59 PolarHBondContact O-N 3Å; K55-T59 PolarHBondContact O-OG1 3.4Å
56	L	43	Very low	42.5	Very low	107 Å²	107	104.3 Å²	104.3	56%	0.56	57%	0.569	S	S	*	*	H	α-helix	trans	-65.6	-39.1	178	-76.3	166.3	0	0	0	112.8	S52 L53 Q58 T59 S60	S52-L56 WeakPolarHBondContact O-CB 3.38Å; S52-L56 VanDerWaalsContact O-CG 3.24Å; S52-L56 WeakPolarHBondContact O-CG 3.43Å; S52-L56 PolarHBondContact O-N 3.09Å; L53-L56 PolarHBondContact O-N 2.93Å; L56-Q58 VanDerWaalsContact C-N 3.32Å; L56-Q58 PolarHBondContact O-N 3.49Å; L56-T59 WeakPolarHBondContact CA-OG1 3.24Å; L56-T59 PolarHBondContact O-N 3.4Å; L56-T59 PolarHBondContact O-OG1 2.88Å; L56-S60 WeakPolarHBondContact O-CB 3.29Å; L56-S60 PolarHBondContact O-N 3.47Å
57	S	43	Very low	42.3	Very low	67 Å²	67	107 Å²	107	47%	0.469	58%	0.581	S	S	.	*	H	α-helix	trans	-63.1	-38.7	176.6	71.1	0	0	0	0	112	L53 Y54 S60	L53-S57 PolarHBondContact O-N 3.08Å; Y54-S57 PolarHBondContact O-OG 2.79Å; Y54-S57 VanDerWaalsContact O-OG 3.05Å; S57-S60 PolarHBondContact O-N 2.85Å
58	Q	40.1	Very low	42.3	Very low	117 Å²	117	109 Å²	109	55%	0.547	60%	0.6	S	S	.	*	H	α-helix	trans	-71.8	-32.3	174.9	-71.1	-173.2	82.6	0	0	113.5	Y54 K55 L56	Y54-Q58 PolarHBondContact O-N 3.13Å; K55-Q58 PolarHBondContact O-N 2.91Å; L56-Q58 VanDerWaalsContact C-N 3.32Å; L56-Q58 PolarHBondContact O-N 3.49Å
59	T	36.8	Very low	42.3	Very low	89 Å²	89	109.5 Å²	109.5	55%	0.546	62%	0.615	S	S	.	*	H	α-helix	trans	-77.5	-22.7	174.4	55	0	0	0	0	114	K55 L56 S61 T62	K55-T59 PolarHBondContact O-N 3Å; K55-T59 PolarHBondContact O-OG1 3.4Å; L56-T59 WeakPolarHBondContact CA-OG1 3.24Å; L56-T59 PolarHBondContact O-N 3.4Å; L56-T59 PolarHBondContact O-OG1 2.88Å; T59-S61 PolarHBondContact O-N 3.16Å; T59-T62 PolarHBondContact O-OG1 2.85Å; T59-T62 VanDerWaalsContact O-OG1 3.08Å
60	S	37.6	Very low	41.9	Very low	76 Å²	76	110.3 Å²	110.3	53%	0.531	63%	0.625	S	S	.	*	H	α-helix	trans	-68.5	-21	179.6	-160.2	0	0	0	0	112.7	L56 S57 T62 L63	L56-S60 WeakPolarHBondContact O-CB 3.29Å; L56-S60 PolarHBondContact O-N 3.47Å; S57-S60 PolarHBondContact O-N 2.85Å; S60-T62 PolarHBondContact O-N 3.08Å; S60-T62 VanDerWaalsContact O-N 3.08Å; S60-L63 PolarHBondContact O-N 3.15Å
61	S	43	Very low	41.8	Very low	101 Å²	101	111.8 Å²	111.8	71%	0.706	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	0.5	179.2	-56.3	0	0	0	0	115.5	T59	T59-S61 PolarHBondContact O-N 3.16Å
62	T	36.9	Very low	41.6	Very low	125 Å²	125	121.5 Å²	121.5	77%	0.767	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	16.8	176.8	46.7	0	0	0	0	114.9	T59 S60	T59-T62 PolarHBondContact O-OG1 2.85Å; T59-T62 VanDerWaalsContact O-OG1 3.08Å; S60-T62 PolarHBondContact O-N 3.08Å; S60-T62 VanDerWaalsContact O-N 3.08Å
63	L	38.7	Very low	41.5	Very low	143 Å²	143	122.7 Å²	122.7	75%	0.749	67%	0.673	S	S	*	*	S	Bend	trans	-77	122.8	163.4	-83.9	166.3	0	0	0	111.1	S60 C65	S60-L63 PolarHBondContact O-N 3.15Å; L63-C65 PolarHBondContact O-N 3.42Å; L63-C65 VanDerWaalsContact O-N 3.11Å
64	H	44.8	Very low	41.6	Very low	157 Å²	157	122.8 Å²	122.8	73%	0.727	67%	0.674	S	S	*	*			trans	-76.3	93.9	-163.9	-164.3	-91.6	0	0	0	113.2	N66	H64-N66 PolarHBondContact CE1-OD1 2.96Å; H64-N66 PolarHBondContact O-N 3.26Å
65	C	30.1	Very low	41.7	Very low	118 Å²	118	123 Å²	123	80%	0.797	69%	0.685	S	S	*	*			trans	-86.9	98.8	170	-70.1	0	0	0	0	111.5	L63 F67	L63-C65 PolarHBondContact O-N 3.42Å; L63-C65 VanDerWaalsContact O-N 3.11Å; C65-F67 VanDerWaalsContact C-N 3.34Å; C65-F67 PolarHBondContact O-N 3.28Å
66	N	49	Very low	41.4	Very low	143 Å²	143	122.2 Å²	122.2	77%	0.765	70%	0.696	S	S	*	*			trans	-69.8	89.9	162.6	-86.2	-18.5	0	0	0	109.7	H64	H64-N66 PolarHBondContact CE1-OD1 2.96Å; H64-N66 PolarHBondContact O-N 3.26Å
67	F	39.2	Very low	41.5	Very low	196 Å²	196	121.6 Å²	121.6	86%	0.86	71%	0.706	S	S	*	*			trans	-141.6	149.7	163.6	-159.4	-109.9	0	0	0	110.4	C65 A69	C65-F67 VanDerWaalsContact C-N 3.34Å; C65-F67 PolarHBondContact O-N 3.28Å; F67-A69 PolarHBondContact O-N 2.64Å
68	S	43.6	Very low	42.3	Very low	102 Å²	102	123 Å²	123	71%	0.713	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-54.4	136.1	-165.7	-172	0	0	0	0	113
69	A	44.6	Very low	44	Very low	87 Å²	87	122 Å²	122	72%	0.719	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-59	126.1	178.8	0	0	0	0	0	111.1	F67	F67-A69 PolarHBondContact O-N 2.64Å
70	P	38.9	Very low	46	Very low	102 Å²	102	121.1 Å²	121.1	66%	0.662	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-70	154.1	167.4	29.4	-32	0	0	0	110.2
71	S	36.1	Very low	48.3	Very low	86 Å²	86	121.2 Å²	121.2	60%	0.601	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-59.1	150.4	177.7	39.8	0	0	0	0	112.4	S73	S71-S73 PolarHBondContact O-N 2.71Å
72	R	47.9	Very low	50.3	Low	269 Å²	269	122.6 Å²	122.6	100%	1.015	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	19.3	-172.7	-91.1	-178	165.6	-162	-3.6	116.6
73	S	45.1	Very low	52.3	Low	88 Å²	88	122.4 Å²	122.4	62%	0.615	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-21.5	-173.1	42.1	0	0	0	0	115.3	S71	S71-S73 PolarHBondContact O-N 2.71Å
74	D	45.6	Very low	54	Low	118 Å²	118	119.8 Å²	119.8	63%	0.631	69%	0.694	S	S	*	*			trans	-125.8	30.5	-159.8	-62.1	-79.3	0	0	0	115.4	C76	D74-C76 PolarHBondContact O-N 3.4Å
75	L	45.8	Very low	55.8	Low	157 Å²	157	116.1 Å²	116.1	82%	0.822	68%	0.676	S	S	*	*			trans	-92	78.5	155	-89.6	77.6	0	0	0	108.9	A77	L75-A77 PolarHBondContact O-N 3.26Å; L75-A77 VanDerWaalsContact O-N 3.12Å
76	C	39.8	Very low	58.4	Low	119 Å²	119	113.9 Å²	113.9	80%	0.804	66%	0.662	S	S	*	*			trans	-50.7	119.4	155.2	-79.6	0	0	0	0	107.8	D74 A78	D74-C76 PolarHBondContact O-N 3.4Å; C76-A78 PolarHBondContact O-N 3.28Å
77	A	46.2	Very low	60.1	Low	94 Å²	94	111.9 Å²	111.9	78%	0.777	65%	0.649	S	S	*	*			trans	-52.8	118	165.3	0	0	0	0	0	107.1	L75 A79	L75-A77 PolarHBondContact O-N 3.26Å; L75-A77 VanDerWaalsContact O-N 3.12Å; A77-A79 PolarHBondContact O-N 3.18Å
78	A	58.8	Low	62.2	Low	97 Å²	97	107.3 Å²	107.3	80%	0.802	63%	0.63	S	S	*	*			trans	-57.4	110.2	-177.8	0	0	0	0	0	107.9	C76 M80	C76-A78 PolarHBondContact O-N 3.28Å; A78-M80 PolarHBondContact O-N 2.93Å; A78-M80 VanDerWaalsContact O-N 3.14Å
79	A	76.1	Confident	64.4	Low	94 Å²	94	105.6 Å²	105.6	78%	0.777	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-64.1	120.1	-174.9	0	0	0	0	0	108.3	A77 T81	A77-A79 PolarHBondContact O-N 3.18Å; A79-T81 PolarHBondContact O-N 3.43Å
80	M	78.9	Confident	66.6	Low	72 Å²	72	104 Å²	104	36%	0.355	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-52	136.7	-179.1	-70.9	171.8	63	0	0	110.7	A78 E84 K85 E88	A78-M80 PolarHBondContact O-N 2.93Å; A78-M80 VanDerWaalsContact O-N 3.14Å; M80-E84 HydrophobicContact CB-CB 4.29Å; M80-E84 HydrophobicContact CE-CB 3.97Å; M80-K85 HydrophobicContact CB-CG 3.91Å; M80-K85 HydrophobicContact CE-CG 4.33Å; M80-K85 WeakPolarHBondContact O-CE 3.11Å; M80-K85 PolarHBondContact O-NZ 3.38Å; M80-E88 HydrophobicContact CE-CB 3.99Å; M80-E88 WeakPolarHBondContact CE-OE2 3.09Å
81	T	85.5	Confident	69	Low	78 Å²	78	102.6 Å²	102.6	48%	0.479	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-67.5	158.7	173.3	64.9	0	0	0	0	110.7	A79 L83 E84 K85	A79-T81 PolarHBondContact O-N 3.43Å; T81-L83 PolarHBondContact O-N 3.47Å; T81-E84 VanDerWaalsContact CB-OE2 3.31Å; T81-E84 WeakPolarHBondContact CB-OE2 3.4Å; T81-E84 WeakPolarHBondContact CG2-OE2 3.48Å; T81-E84 PolarHBondContact N-OE2 2.91Å; T81-E84 PolarHBondContact O-N 3.34Å; T81-E84 VanDerWaalsContact O-N 3.1Å; T81-E84 VanDerWaalsContact OG1-CD 3.26Å; T81-E84 VanDerWaalsContact OG1-CG 3.31Å; T81-E84 WeakPolarHBondContact OG1-CG 3.2Å; T81-E84 PolarHBondContact OG1-N 3.45Å; T81-E84 PolarHBondContact OG1-OE2 3.14Å; T81-K85 WeakPolarHBondContact O-CG 3.35Å; T81-K85 PolarHBondContact O-N 3.26Å
82	E	85.8	Confident	71.5	Confident	129 Å²	129	102 Å²	102	60%	0.603	58%	0.576	S	S	*	*	H	α-helix	trans	-59.9	-29.8	-179.6	-60.1	-51.7	115.3	0	0	113	K85 S86	E82-K85 IonicContact OE1-NZ 3.86Å; E82-K85 PolarHBondContact OE1-NZ 3.09Å; E82-S86 WeakPolarHBondContact O-CB 3.41Å; E82-S86 PolarHBondContact O-N 3.48Å; E82-S86 PolarHBondContact O-OG 2.86Å
83	L	77.1	Confident	73.7	Confident	121 Å²	121	90.3 Å²	90.3	63%	0.634	54%	0.535	S	S	*	.	H	α-helix	trans	-72.8	-41.6	175.4	-175.8	59.6	0	0	0	111.8	T81 S86 M87	T81-L83 PolarHBondContact O-N 3.47Å; L83-S86 WeakPolarHBondContact O-CB 3.49Å; L83-S86 PolarHBondContact O-N 3.29Å; L83-M87 HydrophobicContact CG-CE 4.35Å; L83-M87 WeakPolarHBondContact O-CG 3.47Å; L83-M87 PolarHBondContact O-N 3.13Å
84	E	75.3	Confident	76	Confident	89 Å²	89	86.1 Å²	86.1	42%	0.416	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-43.6	174.8	-70.1	163.2	135.3	0	0	111.3	M80 T81 S86 M87 E88	M80-E84 HydrophobicContact CB-CB 4.29Å; M80-E84 HydrophobicContact CE-CB 3.97Å; T81-E84 VanDerWaalsContact CB-OE2 3.31Å; T81-E84 WeakPolarHBondContact CB-OE2 3.4Å; T81-E84 WeakPolarHBondContact CG2-OE2 3.48Å; T81-E84 PolarHBondContact N-OE2 2.91Å; T81-E84 PolarHBondContact O-N 3.34Å; T81-E84 VanDerWaalsContact O-N 3.1Å; T81-E84 VanDerWaalsContact OG1-CD 3.26Å; T81-E84 VanDerWaalsContact OG1-CG 3.31Å; T81-E84 WeakPolarHBondContact OG1-CG 3.2Å; T81-E84 PolarHBondContact OG1-N 3.45Å; T81-E84 PolarHBondContact OG1-OE2 3.14Å; E84-S86 VanDerWaalsContact C-N 3.28Å; E84-S86 PolarHBondContact O-N 2.88Å; E84-M87 HydrophobicContact CG-CE 4.17Å; E84-M87 PolarHBondContact O-N 3.02Å; E84-E88 WeakPolarHBondContact O-CB 3.44Å; E84-E88 PolarHBondContact O-N 2.92Å
85	K	81.8	Confident	78.2	Confident	79 Å²	79	83.5 Å²	83.5	34%	0.343	49%	0.489	S	S	.	.	H	α-helix	trans	-59.3	-38.2	172.2	-68.3	172.7	-173.9	156.7	0	112.3	M80 T81 E82 S89	M80-K85 HydrophobicContact CB-CG 3.91Å; M80-K85 HydrophobicContact CE-CG 4.33Å; M80-K85 WeakPolarHBondContact O-CE 3.11Å; M80-K85 PolarHBondContact O-NZ 3.38Å; T81-K85 WeakPolarHBondContact O-CG 3.35Å; T81-K85 PolarHBondContact O-N 3.26Å; E82-K85 IonicContact OE1-NZ 3.86Å; E82-K85 PolarHBondContact OE1-NZ 3.09Å; K85-S89 WeakPolarHBondContact O-CB 3.2Å; K85-S89 PolarHBondContact O-N 3.38Å; K85-S89 PolarHBondContact O-OG 2.94Å
86	S	86.1	Confident	80.4	Confident	72 Å²	72	81.2 Å²	81.2	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-67.5	-41.6	178	-61.7	0	0	0	0	111.8	E82 L83 E84 S89 L90	E82-S86 WeakPolarHBondContact O-CB 3.41Å; E82-S86 PolarHBondContact O-N 3.48Å; E82-S86 PolarHBondContact O-OG 2.86Å; L83-S86 WeakPolarHBondContact O-CB 3.49Å; L83-S86 PolarHBondContact O-N 3.29Å; E84-S86 VanDerWaalsContact C-N 3.28Å; E84-S86 PolarHBondContact O-N 2.88Å; S86-S89 PolarHBondContact O-N 3.14Å; S86-L90 PolarHBondContact O-N 3.42Å
87	M	83.5	Confident	83	Confident	100 Å²	100	76.3 Å²	76.3	49%	0.493	43%	0.434	S	S	.	.	H	α-helix	trans	-66.8	-45	175	-67.9	-174.5	-64.3	0	0	111.9	L83 E84 S89 L90 I91	L83-M87 HydrophobicContact CG-CE 4.35Å; L83-M87 WeakPolarHBondContact O-CG 3.47Å; L83-M87 PolarHBondContact O-N 3.13Å; E84-M87 HydrophobicContact CG-CE 4.17Å; E84-M87 PolarHBondContact O-N 3.02Å; M87-S89 VanDerWaalsContact C-N 3.34Å; M87-S89 PolarHBondContact O-N 2.97Å; M87-L90 WeakPolarHBondContact O-CB 3.18Å; M87-L90 PolarHBondContact O-N 3.03Å; M87-I91 WeakPolarHBondContact O-CG1 3.35Å; M87-I91 PolarHBondContact O-N 2.92Å; M87-I91 VanDerWaalsContact O-N 3.09Å
88	E	83.2	Confident	85.1	Confident	100 Å²	100	71.8 Å²	71.8	47%	0.467	40%	0.397	S	S	.	.	H	α-helix	trans	-60	-43.6	174.1	-178.4	-175	-137.3	0	0	111.5	M80 E84 L90 I91 T92	M80-E88 HydrophobicContact CE-CB 3.99Å; M80-E88 WeakPolarHBondContact CE-OE2 3.09Å; E84-E88 WeakPolarHBondContact O-CB 3.44Å; E84-E88 PolarHBondContact O-N 2.92Å; E88-L90 VanDerWaalsContact C-N 3.34Å; E88-L90 PolarHBondContact O-N 3.38Å; E88-I91 PolarHBondContact O-N 3.13Å; E88-T92 VanDerWaalsContact O-CB 3.24Å; E88-T92 WeakPolarHBondContact O-CB 3.48Å; E88-T92 PolarHBondContact O-N 3.39Å; E88-T92 PolarHBondContact O-OG1 3Å
89	S	89.7	Confident	86.2	Confident	66 Å²	66	73 Å²	73	46%	0.462	38%	0.384	S	S	.	.	H	α-helix	trans	-60.8	-42.9	177.2	-64.9	0	0	0	0	111.5	K85 S86 M87 T92 V93	K85-S89 WeakPolarHBondContact O-CB 3.2Å; K85-S89 PolarHBondContact O-N 3.38Å; K85-S89 PolarHBondContact O-OG 2.94Å; S86-S89 PolarHBondContact O-N 3.14Å; M87-S89 VanDerWaalsContact C-N 3.34Å; M87-S89 PolarHBondContact O-N 2.97Å; S89-T92 PolarHBondContact O-N 3.31Å; S89-V93 WeakPolarHBondContact O-CB 3.41Å; S89-V93 WeakPolarHBondContact O-CG2 3.48Å; S89-V93 PolarHBondContact O-N 2.82Å
90	L	91.9	Very high	86.2	Confident	53 Å²	53	73.5 Å²	73.5	28%	0.277	37%	0.371	S	S	.	.	H	α-helix	trans	-60.4	-48.2	176.4	177.4	61.4	0	0	0	112.2	S86 M87 E88 T92 V93 F94 F153 V157	S86-L90 PolarHBondContact O-N 3.42Å; M87-L90 WeakPolarHBondContact O-CB 3.18Å; M87-L90 PolarHBondContact O-N 3.03Å; E88-L90 VanDerWaalsContact C-N 3.34Å; E88-L90 PolarHBondContact O-N 3.38Å; L90-T92 VanDerWaalsContact C-N 3.32Å; L90-T92 PolarHBondContact O-N 2.91Å; L90-V93 PolarHBondContact O-N 2.76Å; L90-F94 PolarHBondContact O-N 3.42Å; L90-F94 VanDerWaalsContact O-N 3.08Å; L90-F153 HydrophobicContact CD1-CE1 3.81Å; L90-F153 HydrophobicContact CD1-CZ 4.46Å; L90-V157 HydrophobicContact CD1-CB 4.24Å; L90-V157 HydrophobicContact CD1-CG1 3.93Å; L90-V157 HydrophobicContact CD1-CG2 3.94Å
91	I	88.2	Confident	85.5	Confident	74 Å²	74	72.9 Å²	72.9	38%	0.379	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-42.5	176.9	-66	162.7	0	0	0	110.5	M87 E88 F94 H95 F150	M87-I91 WeakPolarHBondContact O-CG1 3.35Å; M87-I91 PolarHBondContact O-N 2.92Å; M87-I91 VanDerWaalsContact O-N 3.09Å; E88-I91 PolarHBondContact O-N 3.13Å; I91-F94 PolarHBondContact O-N 2.86Å; I91-H95 PolarHBondContact O-CD2 3.2Å; I91-H95 PolarHBondContact O-N 3.41Å; I91-F150 HydrophobicContact CG1-CE1 4.26Å; I91-F150 HydrophobicContact CG1-CE2 4.02Å; I91-F150 HydrophobicContact CG1-CZ 3.55Å
92	T	89.8	Confident	84.7	Confident	72 Å²	72	72 Å²	72	44%	0.442	39%	0.389	S	S	.	.	H	α-helix	trans	-66.3	-39.7	179.8	-62.6	0	0	0	0	112	E88 S89 L90 R96	E88-T92 VanDerWaalsContact O-CB 3.24Å; E88-T92 WeakPolarHBondContact O-CB 3.48Å; E88-T92 PolarHBondContact O-N 3.39Å; E88-T92 PolarHBondContact O-OG1 3Å; S89-T92 PolarHBondContact O-N 3.31Å; L90-T92 VanDerWaalsContact C-N 3.32Å; L90-T92 PolarHBondContact O-N 2.91Å; T92-R96 VanDerWaalsContact O-CB 3.22Å; T92-R96 WeakPolarHBondContact O-CB 3.5Å; T92-R96 PolarHBondContact O-N 3.08Å
93	V	93.8	Very high	84.1	Confident	25 Å²	25	69.1 Å²	69.1	15%	0.152	38%	0.378	C	S	.	.	H	α-helix	trans	-62	-50.2	173.8	167.7	0	0	0	0	110.3	S89 L90 H95 R96 Y97 L115 E119	S89-V93 WeakPolarHBondContact O-CB 3.41Å; S89-V93 WeakPolarHBondContact O-CG2 3.48Å; S89-V93 PolarHBondContact O-N 2.82Å; L90-V93 PolarHBondContact O-N 2.76Å; V93-H95 PolarHBondContact O-N 2.8Å; V93-R96 WeakPolarHBondContact O-CB 3.33Å; V93-R96 PolarHBondContact O-N 3.38Å; V93-R96 VanDerWaalsContact O-N 3.13Å; V93-Y97 HydrophobicContact CG1-CD2 4.25Å; V93-Y97 HydrophobicContact CG1-CE2 4.17Å; V93-Y97 VanDerWaalsContact O-CD2 3.28Å; V93-Y97 WeakPolarHBondContact O-CD2 3.36Å; V93-Y97 PolarHBondContact O-N 3.45Å; V93-L115 HydrophobicContact CG1-CD1 4.25Å; V93-L115 HydrophobicContact CG1-CG 4.37Å; V93-E119 HydrophobicContact CG1-CG 3.9Å
94	F	92.9	Very high	84.3	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-55.2	-55.9	178.2	175.6	-94.1	0	0	0	111.6	L90 I91 R96 Y97 A98 T105 L107 F150 F153	L90-F94 PolarHBondContact O-N 3.42Å; L90-F94 VanDerWaalsContact O-N 3.08Å; I91-F94 PolarHBondContact O-N 2.86Å; F94-R96 PolarHBondContact O-N 2.68Å; F94-Y97 PolarHBondContact O-N 3.49Å; F94-A98 HydrophobicContact CE1-CB 4.46Å; F94-A98 PolarHBondContact O-N 3.36Å; F94-T105 WeakPolarHBondContact CE1-O 3.46Å; F94-T105 WeakPolarHBondContact CZ-O 3.45Å; F94-L107 HydrophobicContact CD2-CD1 3.5Å; F94-L107 HydrophobicContact CD2-CG 3.89Å; F94-L107 HydrophobicContact CE2-CD1 3.57Å; F94-L107 HydrophobicContact CE2-CG 3.61Å; F94-L107 HydrophobicContact CZ-CG 4.29Å; F94-F150 HydrophobicContact CB-CD2 3.94Å; F94-F150 HydrophobicContact CB-CE2 4.12Å; F94-F150 HydrophobicContact CD1-CB 4.26Å; F94-F150 AromaticContact CD1-CD2 3.72Å; F94-F150 HydrophobicContact CD1-CD2 3.72Å; F94-F150 HydrophobicContact CD1-CG 4.44Å; F94-F150 HydrophobicContact CD2-CD2 4.04Å; F94-F150 HydrophobicContact CE1-CB 3.9Å; F94-F150 HydrophobicContact CE1-CD2 4.22Å; F94-F150 HydrophobicContact CE2-CB 4.47Å; F94-F150 HydrophobicContact CE2-CD2 4.49Å; F94-F150 AromaticContact CG-CD2 3.63Å; F94-F150 HydrophobicContact CG-CD2 3.63Å; F94-F150 HydrophobicContact CG-CE2 4.31Å; F94-F150 HydrophobicContact CZ-CB 4.02Å; F94-F153 HydrophobicContact CB-CD1 4.22Å; F94-F153 HydrophobicContact CB-CE1 4.06Å; F94-F153 HydrophobicContact CD2-CB 3.83Å; F94-F153 AromaticContact CD2-CD1 3.49Å; F94-F153 HydrophobicContact CD2-CD1 3.49Å; F94-F153 VanDerWaalsContact CD2-CD1 3.49Å; F94-F153 HydrophobicContact CD2-CD2 4.14Å; F94-F153 HydrophobicContact CD2-CE1 4.02Å; F94-F153 AromaticContact CD2-CG 3.55Å; F94-F153 HydrophobicContact CD2-CG 3.55Å; F94-F153 HydrophobicContact CE2-CB 3.69Å; F94-F153 HydrophobicContact CE2-CD1 4.26Å; F94-F153 AromaticContact CE2-CG 3.94Å; F94-F153 HydrophobicContact CE2-CG 3.94Å; F94-F153 HydrophobicContact CG-CD1 4.21Å
95	H	91.6	Very high	85	Confident	62 Å²	62	69.7 Å²	69.7	29%	0.287	38%	0.382	S	S	.	.	H	α-helix	trans	-70.3	-12	179.7	-72.9	-61.3	0	0	0	114.2	I91 V93 K99 K104	I91-H95 PolarHBondContact O-CD2 3.2Å; I91-H95 PolarHBondContact O-N 3.41Å; V93-H95 PolarHBondContact O-N 2.8Å; H95-K99 WeakPolarHBondContact O-CD 3.26Å; H95-K99 WeakPolarHBondContact O-CE 3.49Å; H95-K99 WeakPolarHBondContact O-CG 3.11Å; H95-K99 PolarHBondContact O-NZ 3.05Å; H95-K104 PolarHBondContact ND1-O 3.11Å; H95-K104 VanDerWaalsContact ND1-O 3.13Å
96	R	92.9	Very high	85.5	Confident	109 Å²	109	66.4 Å²	66.4	41%	0.411	37%	0.368	S	S	.	.	H	α-helix	trans	-71.5	-42.7	170.7	175.2	167.3	66.4	-128	13	110.6	T92 V93 F94 E119	T92-R96 VanDerWaalsContact O-CB 3.22Å; T92-R96 WeakPolarHBondContact O-CB 3.5Å; T92-R96 PolarHBondContact O-N 3.08Å; V93-R96 WeakPolarHBondContact O-CB 3.33Å; V93-R96 PolarHBondContact O-N 3.38Å; V93-R96 VanDerWaalsContact O-N 3.13Å; F94-R96 PolarHBondContact O-N 2.68Å; R96-E119 IonicContact CZ-OE1 3.68Å; R96-E119 IonicContact NE-OE1 2.72Å; R96-E119 IonicContact NH2-OE1 3.19Å; R96-E119 PolarHBondContact NH2-OE1 3.44Å; R96-E119 IonicContact NH2-OE2 3.7Å; R96-E119 PolarHBondContact NH2-OE2 3.38Å
97	Y	93.7	Very high	85.9	Confident	16 Å²	16	63 Å²	63	6%	0.063	34%	0.344	C	S	.	.	H	α-helix	trans	-83	-36.4	-178.7	-69.1	-73.7	0	0	0	113.4	V93 F94 K99 E100 E111 K114 L115 K118 E119	V93-Y97 HydrophobicContact CG1-CD2 4.25Å; V93-Y97 HydrophobicContact CG1-CE2 4.17Å; V93-Y97 VanDerWaalsContact O-CD2 3.28Å; V93-Y97 WeakPolarHBondContact O-CD2 3.36Å; V93-Y97 PolarHBondContact O-N 3.45Å; F94-Y97 PolarHBondContact O-N 3.49Å; Y97-K99 PolarHBondContact O-N 2.97Å; Y97-K99 VanDerWaalsContact O-N 3.1Å; Y97-E100 PolarHBondContact O-N 3.46Å; Y97-E111 WeakPolarHBondContact O-CG 3.32Å; Y97-K114 HydrophobicContact CD1-CB 4.39Å; Y97-K114 HydrophobicContact CD1-CD 4.15Å; Y97-K114 HydrophobicContact CD1-CG 4.28Å; Y97-K114 HydrophobicContact CE1-CD 4.16Å; Y97-K114 HydrophobicContact CE1-CG 4.08Å; Y97-L115 HydrophobicContact CD1-CB 4.29Å; Y97-L115 HydrophobicContact CD2-CB 3.73Å; Y97-L115 HydrophobicContact CD2-CD1 3.75Å; Y97-L115 HydrophobicContact CD2-CG 3.62Å; Y97-L115 HydrophobicContact CE2-CB 4.16Å; Y97-L115 HydrophobicContact CE2-CG 3.99Å; Y97-L115 HydrophobicContact CG-CB 3.82Å; Y97-L115 HydrophobicContact CG-CD1 4.28Å; Y97-L115 HydrophobicContact CG-CG 4.21Å; Y97-K118 HydrophobicContact CE1-CB 4.47Å; Y97-K118 HydrophobicContact CE1-CG 4.49Å; Y97-K118 WeakPolarHBondContact OH-CB 3.31Å; Y97-E119 HydrophobicContact CE2-CG 3.7Å; Y97-E119 WeakPolarHBondContact CE2-OE1 3.21Å; Y97-E119 VanDerWaalsContact CZ-OE1 3.28Å; Y97-E119 PolarHBondContact OH-OE1 3.01Å
98	A	90.3	Very high	86.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.9	176.7	0	0	0	0	0	114.7	F94 E100 N103 K104 T106 L107	F94-A98 HydrophobicContact CE1-CB 4.46Å; F94-A98 PolarHBondContact O-N 3.36Å; A98-E100 VanDerWaalsContact C-N 3.32Å; A98-N103 CarbonylContact O-C 3.15Å; A98-K104 WeakPolarHBondContact O-CA 3.33Å; A98-T106 WeakPolarHBondContact CA-O 3.3Å; A98-T106 WeakPolarHBondContact CB-O 3.43Å; A98-L107 HydrophobicContact CB-CD2 4.05Å
99	K	82.5	Confident	86.7	Confident	122 Å²	122	59.2 Å²	59.2	53%	0.53	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-4.9	-177.6	-76.3	169.6	-166.5	158.1	0	113.6	H95 Y97 K104	H95-K99 WeakPolarHBondContact O-CD 3.26Å; H95-K99 WeakPolarHBondContact O-CE 3.49Å; H95-K99 WeakPolarHBondContact O-CG 3.11Å; H95-K99 PolarHBondContact O-NZ 3.05Å; Y97-K99 PolarHBondContact O-N 2.97Å; Y97-K99 VanDerWaalsContact O-N 3.1Å; K99-K104 HydrophobicContact CG-CB 4.16Å; K99-K104 HydrophobicContact CG-CD 4.32Å; K99-K104 HydrophobicContact CG-CG 4Å
100	E	74.9	Confident	86.7	Confident	104 Å²	104	64.7 Å²	64.7	49%	0.486	34%	0.342	S	S	.	.	S	Bend	trans	-88.3	-33.2	-171.1	-61.1	-169.2	-176.9	0	0	113.6	Y97 A98 E111 K114	Y97-E100 PolarHBondContact O-N 3.46Å; A98-E100 VanDerWaalsContact C-N 3.32Å; E100-E111 HydrophobicContact CB-CG 4.33Å; E100-E111 PolarHBondContact N-OE1 2.71Å; E100-K114 IonicContact OE1-NZ 2.65Å; E100-K114 PolarHBondContact OE1-NZ 2.97Å; E100-K114 VanDerWaalsContact OE2-CD 3.24Å; E100-K114 WeakPolarHBondContact OE2-CD 3.36Å; E100-K114 IonicContact OE2-NZ 2.62Å; E100-K114 PolarHBondContact OE2-NZ 3.38Å
101	G	64.1	Low	86.8	Confident	60 Å²	60	62.5 Å²	62.5	62%	0.619	33%	0.33	S	S	*	.	S	Bend	trans	-89	-9.2	-179.2	0	0	0	0	0	114.9	E111	G101-E111 WeakPolarHBondContact CA-OE1 3.38Å; G101-E111 PolarHBondContact N-OE1 2.77Å
102	G	69	Low	87	Confident	59 Å²	59	59 Å²	59	61%	0.608	31%	0.312	S	S	*	.	S	Bend	trans	105.9	-29	179.2	0	0	0	0	0	114.4	K104	G102-K104 PolarHBondContact O-N 3.42Å
103	N	74.3	Confident	87	Confident	68 Å²	68	60.4 Å²	60.4	36%	0.364	31%	0.312	S	S	.	.			trans	-89.9	89.2	176.1	-168.2	1	0	0	0	111.8	A98 T105 T106 E147	A98-N103 CarbonylContact O-C 3.15Å; N103-T105 PolarHBondContact O-N 2.64Å; N103-T105 PolarHBondContact OD1-OG1 3.43Å; N103-T106 PolarHBondContact ND2-OG1 3.31Å; N103-T106 PolarHBondContact O-N 3.08Å; N103-E147 PolarHBondContact ND2-OE2 3Å
104	K	81.9	Confident	86.8	Confident	136 Å²	136	62.7 Å²	62.7	59%	0.591	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.7	-168.8	-55.4	-177.4	-178	171.1	0	116	H95 A98 K99 G102	H95-K104 PolarHBondContact ND1-O 3.11Å; H95-K104 VanDerWaalsContact ND1-O 3.13Å; A98-K104 WeakPolarHBondContact O-CA 3.33Å; K99-K104 HydrophobicContact CG-CB 4.16Å; K99-K104 HydrophobicContact CG-CD 4.32Å; K99-K104 HydrophobicContact CG-CG 4Å; G102-K104 PolarHBondContact O-N 3.42Å
105	T	88.3	Confident	86.8	Confident	87 Å²	87	62.9 Å²	62.9	53%	0.534	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-9.1	-174.4	45	0	0	0	0	114.3	F94 N103	F94-T105 WeakPolarHBondContact CE1-O 3.46Å; F94-T105 WeakPolarHBondContact CZ-O 3.45Å; N103-T105 PolarHBondContact O-N 2.64Å; N103-T105 PolarHBondContact OD1-OG1 3.43Å
106	T	92.9	Very high	86.6	Confident	9 Å²	9	60 Å²	60	6%	0.055	31%	0.307	C	S	.	.	S	Bend	trans	-133.5	162.4	-176.9	56.6	0	0	0	0	111.4	A98 N103 E147 L148 D149	A98-T106 WeakPolarHBondContact CA-O 3.3Å; A98-T106 WeakPolarHBondContact CB-O 3.43Å; N103-T106 PolarHBondContact ND2-OG1 3.31Å; N103-T106 PolarHBondContact O-N 3.08Å; T106-E147 WeakPolarHBondContact CB-OE2 3.47Å; T106-E147 HydrophobicContact CG2-CB 4.42Å; T106-E147 PolarHBondContact OG1-OE2 2.95Å; T106-L148 CarbonylContact C-O 3.37Å; T106-L148 WeakPolarHBondContact CA-O 3.44Å; T106-D149 HydrophobicContact CG2-CB 4.35Å
107	L	93.9	Very high	86.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.309	C	S	.	.			trans	-109.6	112	171.2	-69.4	171.7	0	0	0	110.3	F94 A98 E111 L112 L115 E147 L148 F153	F94-L107 HydrophobicContact CD2-CD1 3.5Å; F94-L107 HydrophobicContact CD2-CG 3.89Å; F94-L107 HydrophobicContact CE2-CD1 3.57Å; F94-L107 HydrophobicContact CE2-CG 3.61Å; F94-L107 HydrophobicContact CZ-CG 4.29Å; A98-L107 HydrophobicContact CB-CD2 4.05Å; L107-E111 HydrophobicContact CD2-CB 3.84Å; L107-L112 HydrophobicContact CB-CB 4.47Å; L107-L112 HydrophobicContact CD1-CD1 4.35Å; L107-L115 HydrophobicContact CD1-CD1 3.81Å; L107-E147 CarbonylContact O-C 3.58Å; L107-E147 WeakPolarHBondContact O-CA 3.42Å; L107-L148 PolarHBondContact N-O 2.97Å; L107-L148 PolarHBondContact O-N 3.25Å; L107-L148 VanDerWaalsContact O-N 3.09Å; L107-F153 HydrophobicContact CD1-CD2 3.77Å; L107-F153 HydrophobicContact CD1-CE2 4.02Å; L107-F153 HydrophobicContact CD1-CG 4.36Å
108	S	93.3	Very high	86.1	Confident	24 Å²	24	65.2 Å²	65.2	17%	0.168	34%	0.335	C	S	.	.			trans	-66.5	164.6	168.2	72.6	0	0	0	0	111.5	K110 E111 L112	S108-K110 PolarHBondContact O-N 2.99Å; S108-E111 WeakPolarHBondContact CB-OE2 3.47Å; S108-E111 PolarHBondContact N-OE2 3.2Å; S108-E111 PolarHBondContact O-N 3.26Å; S108-E111 PolarHBondContact OG-OE2 3.28Å; S108-L112 PolarHBondContact O-N 3.22Å
109	K	90.7	Very high	86	Confident	98 Å²	98	68.7 Å²	68.7	43%	0.426	35%	0.351	S	S	.	.	H	α-helix	trans	-49.8	-31.2	173.4	-178.9	176.2	172	179.2	0	114.9	K113 V133 S134 I137	K109-K113 WeakPolarHBondContact O-CB 3.19Å; K109-K113 PolarHBondContact O-N 3.05Å; K109-V133 HydrophobicContact CG-CG1 4.29Å; K109-S134 VanDerWaalsContact CE-OG 3.29Å; K109-S134 WeakPolarHBondContact CE-OG 3.14Å; K109-S134 PolarHBondContact NZ-OG 2.9Å; K109-I137 HydrophobicContact CB-CD1 3.64Å; K109-I137 HydrophobicContact CG-CD1 4.07Å
110	K	90.7	Very high	86.1	Confident	180 Å²	180	65.2 Å²	65.2	78%	0.783	34%	0.338	S	S	*	.	H	α-helix	trans	-77.1	-41.1	178.7	-66.4	177	-176.2	170.3	0	111.5	S108 K114	S108-K110 PolarHBondContact O-N 2.99Å; K110-K114 PolarHBondContact O-N 3.33Å; K110-K114 VanDerWaalsContact O-N 3.08Å
111	E	93.3	Very high	86.1	Confident	7 Å²	7	63.2 Å²	63.2	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-72.8	-42.2	-178.9	-68.5	157.1	126.8	0	0	111.5	Y97 E100 G101 L107 S108 K113 K114 L115	Y97-E111 WeakPolarHBondContact O-CG 3.32Å; E100-E111 HydrophobicContact CB-CG 4.33Å; E100-E111 PolarHBondContact N-OE1 2.71Å; G101-E111 WeakPolarHBondContact CA-OE1 3.38Å; G101-E111 PolarHBondContact N-OE1 2.77Å; L107-E111 HydrophobicContact CD2-CB 3.84Å; S108-E111 WeakPolarHBondContact CB-OE2 3.47Å; S108-E111 PolarHBondContact N-OE2 3.2Å; S108-E111 PolarHBondContact O-N 3.26Å; S108-E111 PolarHBondContact OG-OE2 3.28Å; E111-K113 VanDerWaalsContact C-N 3.32Å; E111-K113 PolarHBondContact O-N 3.05Å; E111-K114 PolarHBondContact O-N 2.87Å; E111-K114 VanDerWaalsContact O-N 3.16Å; E111-L115 WeakPolarHBondContact O-CB 3.5Å; E111-L115 PolarHBondContact O-N 2.91Å
112	L	91.8	Very high	86.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.6	-43.1	173.2	-178.5	66	0	0	0	111.5	L107 S108 K114 L115 M116 V133 I136 I137 L148 F156	L107-L112 HydrophobicContact CB-CB 4.47Å; L107-L112 HydrophobicContact CD1-CD1 4.35Å; S108-L112 PolarHBondContact O-N 3.22Å; L112-K114 VanDerWaalsContact C-N 3.34Å; L112-K114 PolarHBondContact O-N 2.98Å; L112-L115 PolarHBondContact O-N 3.19Å; L112-M116 HydrophobicContact CG-SD 4.43Å; L112-M116 WeakPolarHBondContact O-CG 3.39Å; L112-M116 PolarHBondContact O-N 3.11Å; L112-V133 HydrophobicContact CB-CG1 4.32Å; L112-V133 HydrophobicContact CD2-CG1 3.95Å; L112-V133 HydrophobicContact CG-CG1 4.17Å; L112-I136 HydrophobicContact CD2-CG2 3.98Å; L112-I137 HydrophobicContact CD2-CD1 3.85Å; L112-I137 HydrophobicContact CD2-CG1 3.51Å; L112-L148 HydrophobicContact CD1-CD1 4.46Å; L112-L148 HydrophobicContact CD2-CD1 3.8Å; L112-F156 HydrophobicContact CD1-CE1 4.49Å
113	K	89.3	Confident	86.2	Confident	103 Å²	103	67.9 Å²	67.9	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-57.3	-48.3	174.4	178.4	173.2	171.2	176.3	0	111	K109 E111 L115 M116 E117 V133	K109-K113 WeakPolarHBondContact O-CB 3.19Å; K109-K113 PolarHBondContact O-N 3.05Å; E111-K113 VanDerWaalsContact C-N 3.32Å; E111-K113 PolarHBondContact O-N 3.05Å; K113-L115 PolarHBondContact O-N 2.75Å; K113-M116 PolarHBondContact O-N 3.47Å; K113-E117 WeakPolarHBondContact CE-OE1 3.37Å; K113-E117 HydrophobicContact CG-CG 4.49Å; K113-E117 IonicContact NZ-OE1 2.64Å; K113-E117 WeakPolarHBondContact O-CG 3.49Å; K113-E117 PolarHBondContact O-N 3.4Å; K113-V133 HydrophobicContact CB-CG1 4.15Å; K113-V133 HydrophobicContact CB-CG2 4.09Å; K113-V133 HydrophobicContact CG-CG2 4.26Å
114	K	90.8	Very high	85.5	Confident	73 Å²	73	66.4 Å²	66.4	32%	0.317	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-41.1	179.6	-166.3	-173.9	-173.6	-171.8	0	112.3	Y97 E100 K110 E111 L112 E117 K118	Y97-K114 HydrophobicContact CD1-CB 4.39Å; Y97-K114 HydrophobicContact CD1-CD 4.15Å; Y97-K114 HydrophobicContact CD1-CG 4.28Å; Y97-K114 HydrophobicContact CE1-CD 4.16Å; Y97-K114 HydrophobicContact CE1-CG 4.08Å; E100-K114 IonicContact OE1-NZ 2.65Å; E100-K114 PolarHBondContact OE1-NZ 2.97Å; E100-K114 VanDerWaalsContact OE2-CD 3.24Å; E100-K114 WeakPolarHBondContact OE2-CD 3.36Å; E100-K114 IonicContact OE2-NZ 2.62Å; E100-K114 PolarHBondContact OE2-NZ 3.38Å; K110-K114 PolarHBondContact O-N 3.33Å; K110-K114 VanDerWaalsContact O-N 3.08Å; E111-K114 PolarHBondContact O-N 2.87Å; E111-K114 VanDerWaalsContact O-N 3.16Å; L112-K114 VanDerWaalsContact C-N 3.34Å; L112-K114 PolarHBondContact O-N 2.98Å; K114-E117 PolarHBondContact O-N 2.8Å; K114-K118 HydrophobicContact CG-CG 4.43Å; K114-K118 WeakPolarHBondContact O-CB 3.38Å; K114-K118 WeakPolarHBondContact O-CG 3.31Å; K114-K118 PolarHBondContact O-N 3.41Å
115	L	92.8	Very high	84	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-58.2	-49.6	174.5	-175	162.1	0	0	0	110.4	V93 Y97 L107 E111 L112 K113 E117 K118 E119 F153	V93-L115 HydrophobicContact CG1-CD1 4.25Å; V93-L115 HydrophobicContact CG1-CG 4.37Å; Y97-L115 HydrophobicContact CD1-CB 4.29Å; Y97-L115 HydrophobicContact CD2-CB 3.73Å; Y97-L115 HydrophobicContact CD2-CD1 3.75Å; Y97-L115 HydrophobicContact CD2-CG 3.62Å; Y97-L115 HydrophobicContact CE2-CB 4.16Å; Y97-L115 HydrophobicContact CE2-CG 3.99Å; Y97-L115 HydrophobicContact CG-CB 3.82Å; Y97-L115 HydrophobicContact CG-CD1 4.28Å; Y97-L115 HydrophobicContact CG-CG 4.21Å; L107-L115 HydrophobicContact CD1-CD1 3.81Å; E111-L115 WeakPolarHBondContact O-CB 3.5Å; E111-L115 PolarHBondContact O-N 2.91Å; L112-L115 PolarHBondContact O-N 3.19Å; K113-L115 PolarHBondContact O-N 2.75Å; L115-E117 VanDerWaalsContact C-N 3.33Å; L115-E117 PolarHBondContact O-N 2.96Å; L115-K118 PolarHBondContact O-N 3.1Å; L115-E119 HydrophobicContact CD2-CB 4.48Å; L115-E119 HydrophobicContact CD2-CG 4.37Å; L115-E119 HydrophobicContact CG-CG 4.23Å; L115-E119 WeakPolarHBondContact O-CB 3.43Å; L115-E119 WeakPolarHBondContact O-CG 3.42Å; L115-E119 PolarHBondContact O-N 2.71Å; L115-F153 HydrophobicContact CD1-CE2 3.79Å; L115-F153 HydrophobicContact CD1-CZ 3.9Å; L115-F153 HydrophobicContact CD2-CE2 4.28Å; L115-F153 HydrophobicContact CD2-CZ 4.44Å
116	M	87.2	Confident	82.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.2	-38.7	176.9	-66	178.3	74.8	0	0	112.4	L112 K113 K118 L120 F123 L124 V133 I136 F156	L112-M116 HydrophobicContact CG-SD 4.43Å; L112-M116 WeakPolarHBondContact O-CG 3.39Å; L112-M116 PolarHBondContact O-N 3.11Å; K113-M116 PolarHBondContact O-N 3.47Å; M116-K118 VanDerWaalsContact C-N 3.33Å; M116-K118 PolarHBondContact O-N 3.18Å; M116-L120 HydrophobicContact CG-CD1 4.42Å; M116-L120 CarbonylContact O-C 3.51Å; M116-L120 WeakPolarHBondContact O-CA 3.32Å; M116-L120 WeakPolarHBondContact O-CB 3.35Å; M116-L120 PolarHBondContact O-N 2.66Å; M116-L120 VanDerWaalsContact O-N 3.15Å; M116-F123 HydrophobicContact CE-CD1 4.01Å; M116-F123 HydrophobicContact CE-CE1 4.14Å; M116-L124 VanDerWaalsContact C-CD1 3.47Å; M116-L124 HydrophobicContact CB-CD1 3.75Å; M116-L124 HydrophobicContact CB-CD2 4.27Å; M116-L124 HydrophobicContact CB-CG 4.08Å; M116-L124 HydrophobicContact CE-CD2 3.72Å; M116-L124 HydrophobicContact CE-CG 4.5Å; M116-V133 HydrophobicContact SD-CG2 4.16Å; M116-I136 HydrophobicContact CE-CD1 3.65Å; M116-I136 HydrophobicContact SD-CD1 3.89Å; M116-F156 HydrophobicContact CE-CE2 4.34Å; M116-F156 HydrophobicContact CE-CZ 3.93Å; M116-F156 HydrophobicContact CG-CE1 4.31Å; M116-F156 HydrophobicContact CG-CZ 3.93Å; M116-F156 HydrophobicContact SD-CZ 3.97Å
117	E	86.2	Confident	80.5	Confident	95 Å²	95	69.5 Å²	69.5	44%	0.444	34%	0.344	S	S	.	.	H	α-helix	trans	-68.2	-27	177.7	-74.6	176	171.5	0	0	114.2	K113 K114 L115 L124	K113-E117 WeakPolarHBondContact CE-OE1 3.37Å; K113-E117 HydrophobicContact CG-CG 4.49Å; K113-E117 IonicContact NZ-OE1 2.64Å; K113-E117 WeakPolarHBondContact O-CG 3.49Å; K113-E117 PolarHBondContact O-N 3.4Å; K114-E117 PolarHBondContact O-N 2.8Å; L115-E117 VanDerWaalsContact C-N 3.33Å; L115-E117 PolarHBondContact O-N 2.96Å; E117-L124 HydrophobicContact CB-CD1 4.16Å; E117-L124 HydrophobicContact CG-CD1 3.48Å; E117-L124 VanDerWaalsContact CG-CD1 3.48Å
118	K	89.5	Confident	78.7	Confident	140 Å²	140	79 Å²	79	61%	0.609	39%	0.386	S	S	*	.	H	α-helix	trans	-101.7	-43.6	-175.9	-67.6	-60.5	-175.6	-176.2	0	114	Y97 K114 L115 M116	Y97-K118 HydrophobicContact CE1-CB 4.47Å; Y97-K118 HydrophobicContact CE1-CG 4.49Å; Y97-K118 WeakPolarHBondContact OH-CB 3.31Å; K114-K118 HydrophobicContact CG-CG 4.43Å; K114-K118 WeakPolarHBondContact O-CB 3.38Å; K114-K118 WeakPolarHBondContact O-CG 3.31Å; K114-K118 PolarHBondContact O-N 3.41Å; L115-K118 PolarHBondContact O-N 3.1Å; M116-K118 VanDerWaalsContact C-N 3.33Å; M116-K118 PolarHBondContact O-N 3.18Å
119	E	89.8	Confident	77.4	Confident	73 Å²	73	81.9 Å²	81.9	34%	0.341	40%	0.399	S	S	.	.	H	α-helix	trans	-92.2	-25	-176.7	-48.5	-62.4	144.9	0	0	112.1	V93 R96 Y97 L115	V93-E119 HydrophobicContact CG1-CG 3.9Å; R96-E119 IonicContact CZ-OE1 3.68Å; R96-E119 IonicContact NE-OE1 2.72Å; R96-E119 IonicContact NH2-OE1 3.19Å; R96-E119 PolarHBondContact NH2-OE1 3.44Å; R96-E119 IonicContact NH2-OE2 3.7Å; R96-E119 PolarHBondContact NH2-OE2 3.38Å; Y97-E119 HydrophobicContact CE2-CG 3.7Å; Y97-E119 WeakPolarHBondContact CE2-OE1 3.21Å; Y97-E119 VanDerWaalsContact CZ-OE1 3.28Å; Y97-E119 PolarHBondContact OH-OE1 3.01Å; L115-E119 HydrophobicContact CD2-CB 4.48Å; L115-E119 HydrophobicContact CD2-CG 4.37Å; L115-E119 HydrophobicContact CG-CG 4.23Å; L115-E119 WeakPolarHBondContact O-CB 3.43Å; L115-E119 WeakPolarHBondContact O-CG 3.42Å; L115-E119 PolarHBondContact O-N 2.71Å
120	L	83.3	Confident	76.3	Confident	49 Å²	49	82.5 Å²	82.5	26%	0.257	41%	0.413	S	S	.	.			trans	-127	43.7	-172.9	-55.9	171.1	0	0	0	113.8	M116 N122 F123 L124 F156 L160	M116-L120 HydrophobicContact CG-CD1 4.42Å; M116-L120 CarbonylContact O-C 3.51Å; M116-L120 WeakPolarHBondContact O-CA 3.32Å; M116-L120 WeakPolarHBondContact O-CB 3.35Å; M116-L120 PolarHBondContact O-N 2.66Å; M116-L120 VanDerWaalsContact O-N 3.15Å; L120-N122 VanDerWaalsContact C-N 3.31Å; L120-N122 PolarHBondContact O-N 3.1Å; L120-F123 HydrophobicContact CB-CB 4.11Å; L120-F123 WeakPolarHBondContact O-CB 3.47Å; L120-F123 PolarHBondContact O-N 3.24Å; L120-L124 PolarHBondContact O-N 2.95Å; L120-F156 HydrophobicContact CD1-CE1 3.87Å; L120-F156 HydrophobicContact CD1-CZ 3.98Å; L120-L160 HydrophobicContact CD1-CD1 3.44Å; L120-L160 VanDerWaalsContact CD1-CD1 3.44Å; L120-L160 HydrophobicContact CD2-CD1 4.22Å; L120-L160 HydrophobicContact CG-CD1 4.49Å
121	P	75.2	Confident	75.8	Confident	62 Å²	62	78.2 Å²	78.2	40%	0.403	40%	0.399	S	S	.	.	H	α-helix	trans	-57.3	-41.1	-171.4	23.7	-34.5	0	0	0	113.2	F123 L124 T125	P121-F123 PolarHBondContact O-N 3.18Å; P121-L124 PolarHBondContact O-N 3.48Å; P121-T125 PolarHBondContact O-N 3.24Å; P121-T125 VanDerWaalsContact O-N 3.11Å
122	N	70.6	Confident	75.2	Confident	135 Å²	135	78.7 Å²	78.7	72%	0.722	40%	0.402	S	S	*	.	H	α-helix	trans	-68	-20.8	-180	-61.6	-17.5	0	0	0	113.4	L120 T125	L120-N122 VanDerWaalsContact C-N 3.31Å; L120-N122 PolarHBondContact O-N 3.1Å; N122-T125 WeakPolarHBondContact CA-OG1 3.46Å; N122-T125 PolarHBondContact O-OG1 2.97Å
123	F	65.6	Low	74.9	Confident	82 Å²	82	79.3 Å²	79.3	36%	0.36	41%	0.406	S	S	.	.	H	α-helix	trans	-77.5	-41.1	175	-167.7	-101.3	0	0	0	110.5	M116 L120 P121 T126 L160	M116-F123 HydrophobicContact CE-CD1 4.01Å; M116-F123 HydrophobicContact CE-CE1 4.14Å; L120-F123 HydrophobicContact CB-CB 4.11Å; L120-F123 WeakPolarHBondContact O-CB 3.47Å; L120-F123 PolarHBondContact O-N 3.24Å; P121-F123 PolarHBondContact O-N 3.18Å; F123-T126 PolarHBondContact O-N 2.99Å; F123-L160 HydrophobicContact CD1-CD2 4.38Å; F123-L160 HydrophobicContact CD2-CD2 3.78Å; F123-L160 HydrophobicContact CE1-CD2 4.05Å; F123-L160 HydrophobicContact CE2-CD2 3.4Å; F123-L160 VanDerWaalsContact CE2-CD2 3.4Å; F123-L160 HydrophobicContact CG-CD2 4.26Å; F123-L160 HydrophobicContact CZ-CD2 3.55Å
124	L	58.2	Low	74.7	Confident	37 Å²	37	75.6 Å²	75.6	19%	0.194	39%	0.393	C	S	.	.	H	α-helix	trans	-74.4	-29.5	179.9	-74.1	-176	0	0	0	114.4	M116 E117 L120 P121 T126 Q127	M116-L124 VanDerWaalsContact C-CD1 3.47Å; M116-L124 HydrophobicContact CB-CD1 3.75Å; M116-L124 HydrophobicContact CB-CD2 4.27Å; M116-L124 HydrophobicContact CB-CG 4.08Å; M116-L124 HydrophobicContact CE-CD2 3.72Å; M116-L124 HydrophobicContact CE-CG 4.5Å; E117-L124 HydrophobicContact CB-CD1 4.16Å; E117-L124 HydrophobicContact CG-CD1 3.48Å; E117-L124 VanDerWaalsContact CG-CD1 3.48Å; L120-L124 PolarHBondContact O-N 2.95Å; P121-L124 PolarHBondContact O-N 3.48Å; L124-T126 PolarHBondContact O-N 2.99Å; L124-Q127 HydrophobicContact CD2-CB 4.46Å; L124-Q127 CarbonylContact O-C 3.56Å; L124-Q127 PolarHBondContact O-N 3.29Å
125	T	51.5	Low	74.5	Confident	101 Å²	101	75 Å²	75	62%	0.62	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.5	174.2	45.7	0	0	0	0	113.3	P121 N122	P121-T125 PolarHBondContact O-N 3.24Å; P121-T125 VanDerWaalsContact O-N 3.11Å; N122-T125 WeakPolarHBondContact CA-OG1 3.46Å; N122-T125 PolarHBondContact O-OG1 2.97Å
126	T	52.4	Low	74.1	Confident	116 Å²	116	76 Å²	76	71%	0.712	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-22.3	177	-46.1	0	0	0	0	112.4	F123 L124	F123-T126 PolarHBondContact O-N 2.99Å; L124-T126 PolarHBondContact O-N 2.99Å
127	Q	54.7	Low	74.2	Confident	81 Å²	81	76.3 Å²	76.3	38%	0.379	40%	0.404	S	S	.	.			trans	-102.8	80.3	-175.2	-76.8	-77.7	-21.6	0	0	111.2	L124 N129 T132	L124-Q127 HydrophobicContact CD2-CB 4.46Å; L124-Q127 CarbonylContact O-C 3.56Å; L124-Q127 PolarHBondContact O-N 3.29Å; Q127-N129 PolarHBondContact O-N 3.32Å; Q127-T132 HydrophobicContact CB-CG2 4.45Å; Q127-T132 HydrophobicContact CG-CG2 4.27Å; Q127-T132 PolarHBondContact OE1-OG1 2.91Å
128	K	56.8	Low	74.3	Confident	199 Å²	199	78.8 Å²	78.8	87%	0.865	41%	0.414	S	S	*	.			trans	-73.8	2.7	177.9	-64.9	-173.1	179.1	-178.9	0	115.1
129	N	65.2	Low	74	Confident	84 Å²	84	73.8 Å²	73.8	45%	0.449	39%	0.394	S	S	.	.			trans	-90.6	120	-176	-176.4	-6.7	0	0	0	110.8	Q127 D131 T132	Q127-N129 PolarHBondContact O-N 3.32Å; N129-D131 PolarHBondContact O-N 2.6Å; N129-D131 WeakPolarHBondContact OD1-CB 3Å; N129-D131 PolarHBondContact OD1-N 2.9Å; N129-T132 PolarHBondContact O-N 3.31Å; N129-T132 PolarHBondContact O-OG1 3.14Å
130	P	68	Low	73.8	Confident	111 Å²	111	70.8 Å²	70.8	72%	0.721	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.3	177.5	26.8	-36	0	0	0	113.9
131	D	79.6	Confident	74.1	Confident	91 Å²	91	69.2 Å²	69.2	49%	0.487	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.3	-177.7	-64	-52.1	0	0	0	114.3	N129 V133 S134 S135	N129-D131 PolarHBondContact O-N 2.6Å; N129-D131 WeakPolarHBondContact OD1-CB 3Å; N129-D131 PolarHBondContact OD1-N 2.9Å; D131-V133 PolarHBondContact O-N 3.33Å; D131-S134 PolarHBondContact O-N 2.78Å; D131-S134 VanDerWaalsContact O-N 3.13Å; D131-S135 PolarHBondContact O-N 3.37Å; D131-S135 PolarHBondContact O-OG 2.87Å
132	T	80.8	Confident	74.6	Confident	17 Å²	17	71 Å²	71	10%	0.104	38%	0.375	C	S	.	.	H	α-helix	trans	-57.8	-47	-179.2	-66	0	0	0	0	111.9	Q127 N129 S134 S135 I136	Q127-T132 HydrophobicContact CB-CG2 4.45Å; Q127-T132 HydrophobicContact CG-CG2 4.27Å; Q127-T132 PolarHBondContact OE1-OG1 2.91Å; N129-T132 PolarHBondContact O-N 3.31Å; N129-T132 PolarHBondContact O-OG1 3.14Å; T132-S134 VanDerWaalsContact C-N 3.3Å; T132-S134 PolarHBondContact O-N 2.92Å; T132-S135 WeakPolarHBondContact O-CB 3.39Å; T132-S135 PolarHBondContact O-N 2.77Å; T132-S135 VanDerWaalsContact O-N 3.13Å; T132-I136 HydrophobicContact CG2-CD1 3.87Å; T132-I136 WeakPolarHBondContact O-CG1 3.48Å; T132-I136 PolarHBondContact O-N 3.3Å
133	V	85.1	Confident	75.5	Confident	13 Å²	13	68.4 Å²	68.4	8%	0.079	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-39.4	177.6	-173.9	0	0	0	0	111.3	K109 L112 K113 M116 D131 S135 I136 I137	K109-V133 HydrophobicContact CG-CG1 4.29Å; L112-V133 HydrophobicContact CB-CG1 4.32Å; L112-V133 HydrophobicContact CD2-CG1 3.95Å; L112-V133 HydrophobicContact CG-CG1 4.17Å; K113-V133 HydrophobicContact CB-CG1 4.15Å; K113-V133 HydrophobicContact CB-CG2 4.09Å; K113-V133 HydrophobicContact CG-CG2 4.26Å; M116-V133 HydrophobicContact SD-CG2 4.16Å; D131-V133 PolarHBondContact O-N 3.33Å; V133-S135 VanDerWaalsContact C-N 3.28Å; V133-S135 PolarHBondContact O-N 3.05Å; V133-I136 PolarHBondContact O-N 2.87Å; V133-I137 HydrophobicContact CG1-CD1 4.35Å; V133-I137 PolarHBondContact O-N 3.39Å; V133-I137 VanDerWaalsContact O-N 3.14Å
134	S	86.6	Confident	76.7	Confident	25 Å²	25	72.8 Å²	72.8	18%	0.175	38%	0.38	C	S	.	.	H	α-helix	trans	-68.4	-28.8	177.6	-123.8	0	0	0	0	113	K109 D131 T132 K138	K109-S134 VanDerWaalsContact CE-OG 3.29Å; K109-S134 WeakPolarHBondContact CE-OG 3.14Å; K109-S134 PolarHBondContact NZ-OG 2.9Å; D131-S134 PolarHBondContact O-N 2.78Å; D131-S134 VanDerWaalsContact O-N 3.13Å; T132-S134 VanDerWaalsContact C-N 3.3Å; T132-S134 PolarHBondContact O-N 2.92Å; S134-K138 WeakPolarHBondContact O-CB 3.39Å; S134-K138 VanDerWaalsContact O-CG 3.26Å; S134-K138 WeakPolarHBondContact O-CG 3.11Å; S134-K138 PolarHBondContact O-N 3.36Å
135	S	84.8	Confident	78.3	Confident	59 Å²	59	74.4 Å²	74.4	41%	0.413	39%	0.389	S	S	.	.	H	α-helix	trans	-76.8	-38.6	176.3	-55.7	0	0	0	0	111.4	D131 T132 V133 D139	D131-S135 PolarHBondContact O-N 3.37Å; D131-S135 PolarHBondContact O-OG 2.87Å; T132-S135 WeakPolarHBondContact O-CB 3.39Å; T132-S135 PolarHBondContact O-N 2.77Å; T132-S135 VanDerWaalsContact O-N 3.13Å; V133-S135 VanDerWaalsContact C-N 3.28Å; V133-S135 PolarHBondContact O-N 3.05Å; S135-D139 WeakPolarHBondContact O-CB 3.44Å; S135-D139 PolarHBondContact O-N 3.02Å; S135-D139 VanDerWaalsContact O-N 3.14Å
136	I	86.1	Confident	80.2	Confident	27 Å²	27	74.9 Å²	74.9	14%	0.138	39%	0.388	C	S	.	.	H	α-helix	trans	-60.5	-48.2	175.5	-70.3	163.9	0	0	0	110.8	L112 M116 T132 V133 D139 L140 F156	L112-I136 HydrophobicContact CD2-CG2 3.98Å; M116-I136 HydrophobicContact CE-CD1 3.65Å; M116-I136 HydrophobicContact SD-CD1 3.89Å; T132-I136 HydrophobicContact CG2-CD1 3.87Å; T132-I136 WeakPolarHBondContact O-CG1 3.48Å; T132-I136 PolarHBondContact O-N 3.3Å; V133-I136 PolarHBondContact O-N 2.87Å; I136-D139 PolarHBondContact O-N 3.36Å; I136-L140 HydrophobicContact CG2-CD1 3.58Å; I136-L140 HydrophobicContact CG2-CG 4.48Å; I136-L140 WeakPolarHBondContact O-CB 3.43Å; I136-L140 WeakPolarHBondContact O-CG 3.45Å; I136-L140 PolarHBondContact O-N 3.42Å; I136-F156 HydrophobicContact CD1-CE2 3.99Å; I136-F156 HydrophobicContact CG2-CD2 3.97Å; I136-F156 HydrophobicContact CG2-CE2 4.16Å
137	I	87.9	Confident	82.1	Confident	5 Å²	5	71.7 Å²	71.7	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-55	178.6	-67.2	171.1	0	0	0	110.3	K109 L112 V133 D139 L140 D141 L148	K109-I137 HydrophobicContact CB-CD1 3.64Å; K109-I137 HydrophobicContact CG-CD1 4.07Å; L112-I137 HydrophobicContact CD2-CD1 3.85Å; L112-I137 HydrophobicContact CD2-CG1 3.51Å; V133-I137 HydrophobicContact CG1-CD1 4.35Å; V133-I137 PolarHBondContact O-N 3.39Å; V133-I137 VanDerWaalsContact O-N 3.14Å; I137-D139 CarbonylContact O-C 3.44Å; I137-D139 PolarHBondContact O-N 2.79Å; I137-L140 PolarHBondContact O-N 3.42Å; I137-D141 HydrophobicContact CG2-CB 4.11Å; I137-D141 WeakPolarHBondContact O-CB 3.23Å; I137-D141 PolarHBondContact O-N 2.88Å; I137-L148 HydrophobicContact CG1-CD1 4.13Å; I137-L148 HydrophobicContact CG1-CG 4.24Å
138	K	88.1	Confident	83.9	Confident	148 Å²	148	67.9 Å²	67.9	64%	0.643	35%	0.347	S	S	*	.	H	α-helix	trans	-55.5	-19.4	178.7	-76.7	178.5	177.1	-177.2	0	115.7	S134	S134-K138 WeakPolarHBondContact O-CB 3.39Å; S134-K138 VanDerWaalsContact O-CG 3.26Å; S134-K138 WeakPolarHBondContact O-CG 3.11Å; S134-K138 PolarHBondContact O-N 3.36Å
139	D	84.9	Confident	85.6	Confident	35 Å²	35	60.4 Å²	60.4	19%	0.187	32%	0.316	C	S	.	.	H	α-helix	trans	-87.9	-51.4	173.3	-79.3	-18.6	0	0	0	111.1	V3 K6 S135 I136 I137	V3-D139 HydrophobicContact CB-CB 4.31Å; V3-D139 HydrophobicContact CG1-CB 3.93Å; V3-D139 HydrophobicContact CG2-CB 3.83Å; V3-D139 WeakPolarHBondContact CG2-O 3.35Å; K6-D139 VanDerWaalsContact CD-OD1 3.23Å; K6-D139 WeakPolarHBondContact CD-OD1 2.86Å; K6-D139 WeakPolarHBondContact CD-OD2 3.3Å; K6-D139 WeakPolarHBondContact CE-OD1 3.34Å; K6-D139 IonicContact NZ-OD1 2.6Å; K6-D139 PolarHBondContact NZ-OD1 3.12Å; K6-D139 IonicContact NZ-OD2 3.52Å; S135-D139 WeakPolarHBondContact O-CB 3.44Å; S135-D139 PolarHBondContact O-N 3.02Å; S135-D139 VanDerWaalsContact O-N 3.14Å; I136-D139 PolarHBondContact O-N 3.36Å; I137-D139 CarbonylContact O-C 3.44Å; I137-D139 PolarHBondContact O-N 2.79Å
140	L	84.6	Confident	86.8	Confident	10 Å²	10	59.2 Å²	59.2	5%	0.052	31%	0.307	C	S	.	.	H	α-helix	trans	-78.6	-32.5	-172.3	-66.6	171.7	0	0	0	114.9	V3 I136 I137 Q142 L148 P155 F156	V3-L140 HydrophobicContact CG1-CD2 4.07Å; V3-L140 HydrophobicContact CG2-CD2 4.46Å; I136-L140 HydrophobicContact CG2-CD1 3.58Å; I136-L140 HydrophobicContact CG2-CG 4.48Å; I136-L140 WeakPolarHBondContact O-CB 3.43Å; I136-L140 WeakPolarHBondContact O-CG 3.45Å; I136-L140 PolarHBondContact O-N 3.42Å; I137-L140 PolarHBondContact O-N 3.42Å; L140-Q142 PolarHBondContact O-N 2.94Å; L140-Q142 VanDerWaalsContact O-N 3.08Å; L140-L148 HydrophobicContact CB-CD1 4.46Å; L140-L148 HydrophobicContact CB-CD2 3.6Å; L140-L148 HydrophobicContact CD1-CD1 4.22Å; L140-P155 HydrophobicContact CD2-CB 3.99Å; L140-F156 HydrophobicContact CD1-CB 3.66Å; L140-F156 HydrophobicContact CD1-CD2 4.34Å; L140-F156 HydrophobicContact CD1-CG 4.32Å
141	D	89.1	Confident	87.7	Confident	16 Å²	16	57.9 Å²	57.9	9%	0.086	29%	0.291	C	S	.	.			trans	-63.3	102	175	175.7	8.6	0	0	0	109.1	I137 N143 K144 D145 D146 L148	I137-D141 HydrophobicContact CG2-CB 4.11Å; I137-D141 WeakPolarHBondContact O-CB 3.23Å; I137-D141 PolarHBondContact O-N 2.88Å; D141-N143 PolarHBondContact OD1-N 2.9Å; D141-K144 WeakPolarHBondContact OD1-CA 3.47Å; D141-K144 PolarHBondContact OD1-N 3.06Å; D141-K144 VanDerWaalsContact OD2-CA 3.32Å; D141-K144 WeakPolarHBondContact OD2-CA 3.24Å; D141-D145 PolarHBondContact OD1-N 3.15Å; D141-D145 PolarHBondContact OD2-N 3.36Å; D141-D146 WeakPolarHBondContact OD2-CA 3.34Å; D141-D146 PolarHBondContact OD2-N 3.32Å; D141-L148 HydrophobicContact CB-CD2 4.04Å
142	Q	86.9	Confident	88.1	Confident	98 Å²	98	53.7 Å²	53.7	46%	0.458	27%	0.269	S	S	.	.	S	Bend	trans	-90.5	-31.9	-179.6	-74.3	166.1	72.6	0	0	111	L140 E152	L140-Q142 PolarHBondContact O-N 2.94Å; L140-Q142 VanDerWaalsContact O-N 3.08Å; Q142-E152 WeakPolarHBondContact CB-OE1 3.38Å; Q142-E152 PolarHBondContact N-OE1 2.91Å
143	N	89.4	Confident	88.6	Confident	81 Å²	81	53 Å²	53	43%	0.433	26%	0.264	S	S	.	.	S	Bend	trans	-80.4	-25.4	-175.6	87.6	44.9	0	0	0	112.3	D141 D145 E152	D141-N143 PolarHBondContact OD1-N 2.9Å; N143-D145 PolarHBondContact ND2-OD2 2.96Å; N143-D145 WeakPolarHBondContact OD1-CB 3.37Å; N143-D145 PolarHBondContact OD1-N 3.03Å; N143-D145 PolarHBondContact OD1-OD1 2.9Å; N143-D145 PolarHBondContact OD1-OD2 3.24Å; N143-D145 VanDerWaalsContact OD1-OD2 3.13Å; N143-E152 PolarHBondContact N-OE1 3.15Å
144	K	91.1	Very high	88.7	Confident	175 Å²	175	53.7 Å²	53.7	76%	0.761	27%	0.269	S	S	*	.			trans	72.9	43.6	-178.7	-53.8	179.1	-173.1	170.2	0	115.4	D141	D141-K144 WeakPolarHBondContact OD1-CA 3.47Å; D141-K144 PolarHBondContact OD1-N 3.06Å; D141-K144 VanDerWaalsContact OD2-CA 3.32Å; D141-K144 WeakPolarHBondContact OD2-CA 3.24Å
145	D	90.8	Very high	88.7	Confident	70 Å²	70	54.6 Å²	54.6	37%	0.374	27%	0.274	S	S	.	.	S	Bend	trans	-95.5	1	174.2	67	16.9	0	0	0	114.2	D141 N143 E147	D141-D145 PolarHBondContact OD1-N 3.15Å; D141-D145 PolarHBondContact OD2-N 3.36Å; N143-D145 PolarHBondContact ND2-OD2 2.96Å; N143-D145 WeakPolarHBondContact OD1-CB 3.37Å; N143-D145 PolarHBondContact OD1-N 3.03Å; N143-D145 PolarHBondContact OD1-OD1 2.9Å; N143-D145 PolarHBondContact OD1-OD2 3.24Å; N143-D145 VanDerWaalsContact OD1-OD2 3.13Å; D145-E147 PolarHBondContact O-N 3.14Å; D145-E147 WeakPolarHBondContact OD1-CA 3.48Å; D145-E147 WeakPolarHBondContact OD1-CB 3.34Å; D145-E147 PolarHBondContact OD1-N 2.92Å
146	D	91.4	Very high	88.7	Confident	112 Å²	112	52.8 Å²	52.8	60%	0.599	26%	0.259	S	S	*	.	S	Bend	trans	62.6	11.1	-173.8	-78	-60.4	0	0	0	114.4	D141	D141-D146 WeakPolarHBondContact OD2-CA 3.34Å; D141-D146 PolarHBondContact OD2-N 3.32Å
147	E	91.9	Very high	88.8	Confident	49 Å²	49	53 Å²	53	23%	0.229	26%	0.262	C	S	.	.	S	Bend	trans	-110.6	-169.1	168.7	-48.6	-160.3	132.2	0	0	110.2	N103 T106 L107 D145	N103-E147 PolarHBondContact ND2-OE2 3Å; T106-E147 WeakPolarHBondContact CB-OE2 3.47Å; T106-E147 HydrophobicContact CG2-CB 4.42Å; T106-E147 PolarHBondContact OG1-OE2 2.95Å; L107-E147 CarbonylContact O-C 3.58Å; L107-E147 WeakPolarHBondContact O-CA 3.42Å; D145-E147 PolarHBondContact O-N 3.14Å; D145-E147 WeakPolarHBondContact OD1-CA 3.48Å; D145-E147 WeakPolarHBondContact OD1-CB 3.34Å; D145-E147 PolarHBondContact OD1-N 2.92Å
148	L	92.6	Very high	88.6	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.			trans	-140.6	121.3	170.8	-67.1	177.4	0	0	0	109.4	T106 L107 L112 I137 L140 D141 E152	T106-L148 CarbonylContact C-O 3.37Å; T106-L148 WeakPolarHBondContact CA-O 3.44Å; L107-L148 PolarHBondContact N-O 2.97Å; L107-L148 PolarHBondContact O-N 3.25Å; L107-L148 VanDerWaalsContact O-N 3.09Å; L112-L148 HydrophobicContact CD1-CD1 4.46Å; L112-L148 HydrophobicContact CD2-CD1 3.8Å; I137-L148 HydrophobicContact CG1-CD1 4.13Å; I137-L148 HydrophobicContact CG1-CG 4.24Å; L140-L148 HydrophobicContact CB-CD1 4.46Å; L140-L148 HydrophobicContact CB-CD2 3.6Å; L140-L148 HydrophobicContact CD1-CD1 4.22Å; D141-L148 HydrophobicContact CB-CD2 4.04Å; L148-E152 HydrophobicContact CB-CB 4.44Å; L148-E152 HydrophobicContact CD2-CB 3.99Å
149	D	92.8	Very high	88.2	Confident	43 Å²	43	49.2 Å²	49.2	23%	0.23	26%	0.261	C	S	.	.			trans	-73	177	168	79	29.3	0	0	0	111.9	T106 E151 E152 F153	T106-D149 HydrophobicContact CG2-CB 4.35Å; D149-E151 VanDerWaalsContact C-N 3.31Å; D149-E151 PolarHBondContact O-N 3.09Å; D149-E151 WeakPolarHBondContact OD1-CA 3.39Å; D149-E151 WeakPolarHBondContact OD1-CB 3.39Å; D149-E151 PolarHBondContact OD1-N 2.99Å; D149-E152 PolarHBondContact N-OE2 3.42Å; D149-E152 VanDerWaalsContact N-OE2 3.08Å; D149-E152 PolarHBondContact O-N 3.45Å; D149-E152 PolarHBondContact OD1-N 2.73Å; D149-F153 VanDerWaalsContact O-CB 3.3Å; D149-F153 WeakPolarHBondContact O-CB 3.48Å; D149-F153 PolarHBondContact O-N 3.23Å
150	F	90	Very high	88.1	Confident	59 Å²	59	48.6 Å²	48.6	26%	0.259	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-33.9	-179.2	-175.4	-107.2	0	0	0	113	I91 F94 F153 V154	I91-F150 HydrophobicContact CG1-CE1 4.26Å; I91-F150 HydrophobicContact CG1-CE2 4.02Å; I91-F150 HydrophobicContact CG1-CZ 3.55Å; F94-F150 HydrophobicContact CB-CD2 3.94Å; F94-F150 HydrophobicContact CB-CE2 4.12Å; F94-F150 HydrophobicContact CD1-CB 4.26Å; F94-F150 AromaticContact CD1-CD2 3.72Å; F94-F150 HydrophobicContact CD1-CD2 3.72Å; F94-F150 HydrophobicContact CD1-CG 4.44Å; F94-F150 HydrophobicContact CD2-CD2 4.04Å; F94-F150 HydrophobicContact CE1-CB 3.9Å; F94-F150 HydrophobicContact CE1-CD2 4.22Å; F94-F150 HydrophobicContact CE2-CB 4.47Å; F94-F150 HydrophobicContact CE2-CD2 4.49Å; F94-F150 AromaticContact CG-CD2 3.63Å; F94-F150 HydrophobicContact CG-CD2 3.63Å; F94-F150 HydrophobicContact CG-CE2 4.31Å; F94-F150 HydrophobicContact CZ-CB 4.02Å; F150-F153 HydrophobicContact CD2-CD1 4.33Å; F150-F153 HydrophobicContact CE2-CD1 4.38Å; F150-F153 PolarHBondContact O-N 3.22Å; F150-V154 HydrophobicContact CD1-CG2 4.13Å; F150-V154 HydrophobicContact CE1-CG2 3.67Å; F150-V154 HydrophobicContact CE2-CG2 4.2Å; F150-V154 HydrophobicContact CZ-CG2 3.7Å; F150-V154 VanDerWaalsContact O-CG2 3.32Å; F150-V154 WeakPolarHBondContact O-CG2 3.5Å; F150-V154 PolarHBondContact O-N 2.86Å
151	E	88.1	Confident	88	Confident	82 Å²	82	52.4 Å²	52.4	38%	0.383	28%	0.281	S	S	.	.	H	α-helix	trans	-76.2	-28	-179.1	-58.8	-177.3	-176.7	0	0	111.8	R44 D149 P155	R44-E151 IonicContact CZ-OE2 2.83Å; R44-E151 IonicContact NE-OE2 2.77Å; R44-E151 PolarHBondContact NE-OE2 3.35Å; R44-E151 IonicContact NH1-OE2 3.75Å; R44-E151 IonicContact NH2-OE2 2.64Å; R44-E151 PolarHBondContact NH2-OE2 3.36Å; D149-E151 VanDerWaalsContact C-N 3.31Å; D149-E151 PolarHBondContact O-N 3.09Å; D149-E151 WeakPolarHBondContact OD1-CA 3.39Å; D149-E151 WeakPolarHBondContact OD1-CB 3.39Å; D149-E151 PolarHBondContact OD1-N 2.99Å; E151-P155 WeakPolarHBondContact O-CD 3.48Å
152	E	88.1	Confident	87.5	Confident	3 Å²	3	55.7 Å²	55.7	1%	0.014	30%	0.298	C	S	.	.	H	α-helix	trans	-79.3	-29.3	170.5	-65.5	171.8	143	0	0	112.3	Q142 N143 L148 D149 P155	Q142-E152 WeakPolarHBondContact CB-OE1 3.38Å; Q142-E152 PolarHBondContact N-OE1 2.91Å; N143-E152 PolarHBondContact N-OE1 3.15Å; L148-E152 HydrophobicContact CB-CB 4.44Å; L148-E152 HydrophobicContact CD2-CB 3.99Å; D149-E152 PolarHBondContact N-OE2 3.42Å; D149-E152 VanDerWaalsContact N-OE2 3.08Å; D149-E152 PolarHBondContact O-N 3.45Å; D149-E152 PolarHBondContact OD1-N 2.73Å; E152-P155 WeakPolarHBondContact O-CD 3.49Å
153	F	90	Very high	87	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.009	30%	0.297	C	S	.	.	H	α-helix	trans	-74.5	-37.8	173.4	174.7	-103.2	0	0	0	113.9	L90 F94 L107 L115 D149 F150 F156 V157	L90-F153 HydrophobicContact CD1-CE1 3.81Å; L90-F153 HydrophobicContact CD1-CZ 4.46Å; F94-F153 HydrophobicContact CB-CD1 4.22Å; F94-F153 HydrophobicContact CB-CE1 4.06Å; F94-F153 HydrophobicContact CD2-CB 3.83Å; F94-F153 AromaticContact CD2-CD1 3.49Å; F94-F153 HydrophobicContact CD2-CD1 3.49Å; F94-F153 VanDerWaalsContact CD2-CD1 3.49Å; F94-F153 HydrophobicContact CD2-CD2 4.14Å; F94-F153 HydrophobicContact CD2-CE1 4.02Å; F94-F153 AromaticContact CD2-CG 3.55Å; F94-F153 HydrophobicContact CD2-CG 3.55Å; F94-F153 HydrophobicContact CE2-CB 3.69Å; F94-F153 HydrophobicContact CE2-CD1 4.26Å; F94-F153 AromaticContact CE2-CG 3.94Å; F94-F153 HydrophobicContact CE2-CG 3.94Å; F94-F153 HydrophobicContact CG-CD1 4.21Å; L107-F153 HydrophobicContact CD1-CD2 3.77Å; L107-F153 HydrophobicContact CD1-CE2 4.02Å; L107-F153 HydrophobicContact CD1-CG 4.36Å; L115-F153 HydrophobicContact CD1-CE2 3.79Å; L115-F153 HydrophobicContact CD1-CZ 3.9Å; L115-F153 HydrophobicContact CD2-CE2 4.28Å; L115-F153 HydrophobicContact CD2-CZ 4.44Å; D149-F153 VanDerWaalsContact O-CB 3.3Å; D149-F153 WeakPolarHBondContact O-CB 3.48Å; D149-F153 PolarHBondContact O-N 3.23Å; F150-F153 HydrophobicContact CD2-CD1 4.33Å; F150-F153 HydrophobicContact CE2-CD1 4.38Å; F150-F153 PolarHBondContact O-N 3.22Å; F153-F156 HydrophobicContact CD2-CD1 4.23Å; F153-F156 AromaticContact CE2-CD1 3.86Å; F153-F156 HydrophobicContact CE2-CD1 3.86Å; F153-F156 HydrophobicContact CE2-CE1 4.45Å; F153-F156 WeakPolarHBondContact O-CB 3.35Å; F153-F156 PolarHBondContact O-N 3.17Å; F153-V157 HydrophobicContact CD1-CG2 4.38Å; F153-V157 HydrophobicContact CE1-CG2 3.68Å; F153-V157 HydrophobicContact CE2-CG2 4.03Å; F153-V157 HydrophobicContact CZ-CG2 3.47Å; F153-V157 VanDerWaalsContact CZ-CG2 3.47Å; F153-V157 PolarHBondContact O-N 3.23Å
154	V	88.2	Confident	86.3	Confident	29 Å²	29	53.8 Å²	53.8	18%	0.176	30%	0.304	C	S	.	.	H	α-helix	trans	-53.9	-43.7	-179.2	162.2	0	0	0	0	113.5	L47 F150 F156 V157 A158	L47-V154 HydrophobicContact CD1-CG1 4.37Å; F150-V154 HydrophobicContact CD1-CG2 4.13Å; F150-V154 HydrophobicContact CE1-CG2 3.67Å; F150-V154 HydrophobicContact CE2-CG2 4.2Å; F150-V154 HydrophobicContact CZ-CG2 3.7Å; F150-V154 VanDerWaalsContact O-CG2 3.32Å; F150-V154 WeakPolarHBondContact O-CG2 3.5Å; F150-V154 PolarHBondContact O-N 2.86Å; V154-F156 VanDerWaalsContact C-N 3.28Å; V154-F156 PolarHBondContact O-N 3.38Å; V154-V157 PolarHBondContact O-N 3.46Å; V154-A158 WeakPolarHBondContact O-CB 3.41Å; V154-A158 PolarHBondContact O-N 3.42Å
155	P	85.2	Confident	85.8	Confident	44 Å²	44	51 Å²	51	29%	0.286	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-30.8	173.5	-27.6	34.2	0	0	0	115.4	L140 E151 E152 G159	L140-P155 HydrophobicContact CD2-CB 3.99Å; E151-P155 WeakPolarHBondContact O-CD 3.48Å; E152-P155 WeakPolarHBondContact O-CD 3.49Å; P155-G159 PolarHBondContact O-N 3.26Å
156	F	86.4	Confident	84.9	Confident	20 Å²	20	52.8 Å²	52.8	9%	0.088	30%	0.298	C	S	.	.	H	α-helix	trans	-61	-53.7	174.1	175.8	-119.7	0	0	0	110.5	L112 M116 L120 I136 L140 F153 V154 G159 L160	L112-F156 HydrophobicContact CD1-CE1 4.49Å; M116-F156 HydrophobicContact CE-CE2 4.34Å; M116-F156 HydrophobicContact CE-CZ 3.93Å; M116-F156 HydrophobicContact CG-CE1 4.31Å; M116-F156 HydrophobicContact CG-CZ 3.93Å; M116-F156 HydrophobicContact SD-CZ 3.97Å; L120-F156 HydrophobicContact CD1-CE1 3.87Å; L120-F156 HydrophobicContact CD1-CZ 3.98Å; I136-F156 HydrophobicContact CD1-CE2 3.99Å; I136-F156 HydrophobicContact CG2-CD2 3.97Å; I136-F156 HydrophobicContact CG2-CE2 4.16Å; L140-F156 HydrophobicContact CD1-CB 3.66Å; L140-F156 HydrophobicContact CD1-CD2 4.34Å; L140-F156 HydrophobicContact CD1-CG 4.32Å; F153-F156 HydrophobicContact CD2-CD1 4.23Å; F153-F156 AromaticContact CE2-CD1 3.86Å; F153-F156 HydrophobicContact CE2-CD1 3.86Å; F153-F156 HydrophobicContact CE2-CE1 4.45Å; F153-F156 WeakPolarHBondContact O-CB 3.35Å; F153-F156 PolarHBondContact O-N 3.17Å; V154-F156 VanDerWaalsContact C-N 3.28Å; V154-F156 PolarHBondContact O-N 3.38Å; F156-G159 PolarHBondContact O-N 3.11Å; F156-L160 HydrophobicContact CD1-CD1 4.25Å; F156-L160 HydrophobicContact CE1-CD1 3.79Å; F156-L160 HydrophobicContact CE2-CD1 4.18Å; F156-L160 HydrophobicContact CZ-CD1 3.75Å; F156-L160 WeakPolarHBondContact O-CG 3.47Å; F156-L160 PolarHBondContact O-N 3.47Å; F156-L160 VanDerWaalsContact O-N 3.1Å
157	V	87.1	Confident	83.9	Confident	33 Å²	33	52.8 Å²	52.8	20%	0.2	29%	0.294	C	S	.	.	H	α-helix	trans	-69.3	-39	-177	-177.8	0	0	0	0	111.1	L90 F153 V154 G159 L160 T161	L90-V157 HydrophobicContact CD1-CB 4.24Å; L90-V157 HydrophobicContact CD1-CG1 3.93Å; L90-V157 HydrophobicContact CD1-CG2 3.94Å; F153-V157 HydrophobicContact CD1-CG2 4.38Å; F153-V157 HydrophobicContact CE1-CG2 3.68Å; F153-V157 HydrophobicContact CE2-CG2 4.03Å; F153-V157 HydrophobicContact CZ-CG2 3.47Å; F153-V157 VanDerWaalsContact CZ-CG2 3.47Å; F153-V157 PolarHBondContact O-N 3.23Å; V154-V157 PolarHBondContact O-N 3.46Å; V157-G159 VanDerWaalsContact C-N 3.29Å; V157-G159 PolarHBondContact O-N 2.92Å; V157-L160 PolarHBondContact O-N 3.3Å; V157-L160 VanDerWaalsContact O-N 3.15Å; V157-T161 PolarHBondContact O-N 3.49Å; V157-T161 PolarHBondContact O-OG1 3.49Å; V157-T161 VanDerWaalsContact O-OG1 3.12Å
158	A	84.6	Confident	82.9	Confident	46 Å²	46	56.6 Å²	56.6	38%	0.38	31%	0.307	S	S	.	.	H	α-helix	trans	-57.9	-41.7	172.7	0	0	0	0	0	112.2	V154 T161 I162	V154-A158 WeakPolarHBondContact O-CB 3.41Å; V154-A158 PolarHBondContact O-N 3.42Å; A158-T161 PolarHBondContact O-N 3.35Å; A158-I162 WeakPolarHBondContact O-CD1 3.49Å; A158-I162 WeakPolarHBondContact O-CG1 3.35Å; A158-I162 PolarHBondContact O-N 3.14Å
159	G	80.1	Confident	82	Confident	27 Å²	27	58.7 Å²	58.7	28%	0.278	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-40.7	174.7	0	0	0	0	0	113.3	P155 F156 V157 A163	P155-G159 PolarHBondContact O-N 3.26Å; F156-G159 PolarHBondContact O-N 3.11Å; V157-G159 VanDerWaalsContact C-N 3.29Å; V157-G159 PolarHBondContact O-N 2.92Å; G159-A163 PolarHBondContact O-N 2.68Å; G159-A163 VanDerWaalsContact O-N 3.14Å
160	L	81.6	Confident	80.7	Confident	22 Å²	22	62 Å²	62	12%	0.115	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-47.3	174.8	-66.1	174	0	0	0	111.9	L120 F123 F156 V157 I162 A163 C164	L120-L160 HydrophobicContact CD1-CD1 3.44Å; L120-L160 VanDerWaalsContact CD1-CD1 3.44Å; L120-L160 HydrophobicContact CD2-CD1 4.22Å; L120-L160 HydrophobicContact CG-CD1 4.49Å; F123-L160 HydrophobicContact CD1-CD2 4.38Å; F123-L160 HydrophobicContact CD2-CD2 3.78Å; F123-L160 HydrophobicContact CE1-CD2 4.05Å; F123-L160 HydrophobicContact CE2-CD2 3.4Å; F123-L160 VanDerWaalsContact CE2-CD2 3.4Å; F123-L160 HydrophobicContact CG-CD2 4.26Å; F123-L160 HydrophobicContact CZ-CD2 3.55Å; F156-L160 HydrophobicContact CD1-CD1 4.25Å; F156-L160 HydrophobicContact CE1-CD1 3.79Å; F156-L160 HydrophobicContact CE2-CD1 4.18Å; F156-L160 HydrophobicContact CZ-CD1 3.75Å; F156-L160 WeakPolarHBondContact O-CG 3.47Å; F156-L160 PolarHBondContact O-N 3.47Å; F156-L160 VanDerWaalsContact O-N 3.1Å; V157-L160 PolarHBondContact O-N 3.3Å; V157-L160 VanDerWaalsContact O-N 3.15Å; L160-I162 VanDerWaalsContact C-N 3.32Å; L160-I162 PolarHBondContact O-N 3.41Å; L160-A163 WeakPolarHBondContact O-CA 3.26Å; L160-A163 WeakPolarHBondContact O-CB 3.24Å; L160-A163 PolarHBondContact O-N 3.08Å; L160-C164 PolarHBondContact O-N 2.95Å; L160-C164 PolarHBondContact O-SG 3.49Å; L160-C164 VanDerWaalsContact O-SG 3.42Å
161	T	83.2	Confident	79.2	Confident	89 Å²	89	64.7 Å²	64.7	55%	0.546	36%	0.355	S	S	.	.	H	α-helix	trans	-57.9	-43.2	177.9	-58.2	0	0	0	0	111.7	V157 A158 A163 C164 E165	V157-T161 PolarHBondContact O-N 3.49Å; V157-T161 PolarHBondContact O-OG1 3.49Å; V157-T161 VanDerWaalsContact O-OG1 3.12Å; A158-T161 PolarHBondContact O-N 3.35Å; T161-A163 VanDerWaalsContact C-N 3.31Å; T161-A163 PolarHBondContact O-N 3.19Å; T161-C164 PolarHBondContact O-N 3.09Å; T161-E165 PolarHBondContact O-N 2.79Å
162	I	79.1	Confident	77.8	Confident	86 Å²	86	65.8 Å²	65.8	44%	0.441	36%	0.36	S	S	.	.	H	α-helix	trans	-64.3	-34.9	175.5	-69.1	161	0	0	0	111.9	A158 L160 K166	A158-I162 WeakPolarHBondContact O-CD1 3.49Å; A158-I162 WeakPolarHBondContact O-CG1 3.35Å; A158-I162 PolarHBondContact O-N 3.14Å; L160-I162 VanDerWaalsContact C-N 3.32Å; L160-I162 PolarHBondContact O-N 3.41Å; I162-K166 WeakPolarHBondContact O-CG 3.4Å; I162-K166 PolarHBondContact O-N 3.4Å
163	A	75	Confident	76.1	Confident	53 Å²	53	73.5 Å²	73.5	44%	0.438	40%	0.396	S	S	.	.	H	α-helix	trans	-70.3	-40.5	175.4	0	0	0	0	0	112	G159 L160 T161 K166 H167	G159-A163 PolarHBondContact O-N 2.68Å; G159-A163 VanDerWaalsContact O-N 3.14Å; L160-A163 WeakPolarHBondContact O-CA 3.26Å; L160-A163 WeakPolarHBondContact O-CB 3.24Å; L160-A163 PolarHBondContact O-N 3.08Å; T161-A163 VanDerWaalsContact C-N 3.31Å; T161-A163 PolarHBondContact O-N 3.19Å; A163-K166 PolarHBondContact O-N 2.85Å; A163-H167 PolarHBondContact O-N 3.43Å; A163-H167 VanDerWaalsContact O-N 3.11Å
164	C	76	Confident	74.3	Confident	86 Å²	86	80 Å²	80	58%	0.581	43%	0.431	S	S	*	.	H	α-helix	trans	-62.6	-44	174.3	-69.6	0	0	0	0	112.1	L160 T161 K166 H167 Y168	L160-C164 PolarHBondContact O-N 2.95Å; L160-C164 PolarHBondContact O-SG 3.49Å; L160-C164 VanDerWaalsContact O-SG 3.42Å; T161-C164 PolarHBondContact O-N 3.09Å; C164-K166 PolarHBondContact O-N 2.99Å; C164-H167 WeakPolarHBondContact O-CB 3.46Å; C164-H167 PolarHBondContact O-N 3.15Å; C164-Y168 WeakPolarHBondContact O-CB 3.24Å; C164-Y168 PolarHBondContact O-N 3.16Å
165	E	79	Confident	72.4	Confident	117 Å²	117	87.4 Å²	87.4	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-60.5	-44.6	177	178	56.7	-159.5	0	0	111.9	T161 H167 Y168 A169	T161-E165 PolarHBondContact O-N 2.79Å; E165-H167 VanDerWaalsContact C-N 3.31Å; E165-H167 PolarHBondContact O-N 3.01Å; E165-Y168 PolarHBondContact O-N 3.23Å; E165-A169 PolarHBondContact O-N 3.46Å
166	K	73.1	Confident	70.6	Confident	106 Å²	106	88.6 Å²	88.6	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-41.4	174.5	-72.9	173.1	-178.3	-179.3	0	112.3	I162 A163 C164 L170	I162-K166 WeakPolarHBondContact O-CG 3.4Å; I162-K166 PolarHBondContact O-N 3.4Å; A163-K166 PolarHBondContact O-N 2.85Å; C164-K166 PolarHBondContact O-N 2.99Å; K166-L170 WeakPolarHBondContact O-CD1 3.45Å; K166-L170 VanDerWaalsContact O-CG 3.24Å; K166-L170 WeakPolarHBondContact O-CG 3.39Å; K166-L170 PolarHBondContact O-N 3.37Å
167	H	70.7	Confident	68.8	Low	113 Å²	113	97.5 Å²	97.5	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-66.3	-43.5	176.6	-178.5	73.3	0	0	0	111.5	A163 C164 E165 L170 H171	A163-H167 PolarHBondContact O-N 3.43Å; A163-H167 VanDerWaalsContact O-N 3.11Å; C164-H167 WeakPolarHBondContact O-CB 3.46Å; C164-H167 PolarHBondContact O-N 3.15Å; E165-H167 VanDerWaalsContact C-N 3.31Å; E165-H167 PolarHBondContact O-N 3.01Å; H167-L170 PolarHBondContact O-N 3.19Å; H167-H171 AromaticContact CE1-CD2 3.23Å; H167-H171 PolarHBondContact CE1-CD2 3.31Å; H167-H171 AromaticContact CE1-NE2 3.15Å; H167-H171 PolarHBondContact CE1-NE2 3.22Å; H167-H171 AromaticContact ND1-CD2 3.52Å; H167-H171 AromaticContact ND1-NE2 3.66Å; H167-H171 AromaticContact NE2-CD2 3.64Å; H167-H171 AromaticContact NE2-NE2 3.89Å; H167-H171 PolarHBondContact O-CD2 3.09Å; H167-H171 VanDerWaalsContact O-CD2 3.31Å; H167-H171 PolarHBondContact O-N 3.48Å; H167-H171 VanDerWaalsContact O-N 3.16Å
168	Y	71.1	Confident	66.5	Low	128 Å²	128	109.5 Å²	109.5	50%	0.502	57%	0.569	S	S	.	*	H	α-helix	trans	-58.8	-48.5	176.8	-179.9	-103.4	0	0	0	111.9	C164 E165 L170 H171 H172	C164-Y168 WeakPolarHBondContact O-CB 3.24Å; C164-Y168 PolarHBondContact O-N 3.16Å; E165-Y168 PolarHBondContact O-N 3.23Å; Y168-L170 PolarHBondContact O-N 2.93Å; Y168-H171 PolarHBondContact O-N 3.43Å; Y168-H172 AromaticContact CD2-CD2 3.92Å; Y168-H172 AromaticContact CE2-CD2 3.45Å; Y168-H172 VanDerWaalsContact CE2-CD2 3.45Å; Y168-H172 WeakPolarHBondContact CE2-CD2 3.47Å; Y168-H172 AromaticContact CE2-NE2 3.39Å; Y168-H172 WeakPolarHBondContact CE2-NE2 3.21Å; Y168-H172 AromaticContact CZ-CD2 3.65Å; Y168-H172 AromaticContact CZ-CE1 3.89Å; Y168-H172 AromaticContact CZ-NE2 3.6Å; Y168-H172 PolarHBondContact O-N 2.84Å; Y168-H172 PolarHBondContact OH-CE1 3.32Å
169	A	73.8	Confident	65.6	Low	45 Å²	45	112.7 Å²	112.7	37%	0.372	58%	0.579	S	S	.	*	H	α-helix	trans	-56.6	-50	176.4	0	0	0	0	0	112.4	E165 H171 H172 E173	E165-A169 PolarHBondContact O-N 3.46Å; A169-H171 PolarHBondContact O-N 3.3Å; A169-H172 PolarHBondContact O-N 3.3Å; A169-H172 VanDerWaalsContact O-N 3.15Å; A169-E173 PolarHBondContact O-N 3.41Å
170	L	65.5	Low	64.8	Low	112 Å²	112	117.2 Å²	117.2	59%	0.586	59%	0.594	S	S	*	*	H	α-helix	trans	-59.6	-31.5	179.3	-71.9	168.7	0	0	0	113.7	K166 H167 Y168 N174	K166-L170 WeakPolarHBondContact O-CD1 3.45Å; K166-L170 VanDerWaalsContact O-CG 3.24Å; K166-L170 WeakPolarHBondContact O-CG 3.39Å; K166-L170 PolarHBondContact O-N 3.37Å; H167-L170 PolarHBondContact O-N 3.19Å; Y168-L170 PolarHBondContact O-N 2.93Å; L170-N174 PolarHBondContact O-ND2 3.28Å
171	H	58.1	Low	63.9	Low	115 Å²	115	122.4 Å²	122.4	53%	0.532	62%	0.621	S	S	.	*	H	α-helix	trans	-89.4	-17.7	179.1	-79.4	-81.9	0	0	0	113.9	H167 Y168 A169	H167-H171 AromaticContact CE1-CD2 3.23Å; H167-H171 PolarHBondContact CE1-CD2 3.31Å; H167-H171 AromaticContact CE1-NE2 3.15Å; H167-H171 PolarHBondContact CE1-NE2 3.22Å; H167-H171 AromaticContact ND1-CD2 3.52Å; H167-H171 AromaticContact ND1-NE2 3.66Å; H167-H171 AromaticContact NE2-CD2 3.64Å; H167-H171 AromaticContact NE2-NE2 3.89Å; H167-H171 PolarHBondContact O-CD2 3.09Å; H167-H171 VanDerWaalsContact O-CD2 3.31Å; H167-H171 PolarHBondContact O-N 3.48Å; H167-H171 VanDerWaalsContact O-N 3.16Å; Y168-H171 PolarHBondContact O-N 3.43Å; A169-H171 PolarHBondContact O-N 3.3Å
172	H	58.2	Low	62.7	Low	106 Å²	106	124.4 Å²	124.4	49%	0.491	63%	0.625	S	S	.	*	H	α-helix	trans	-84.1	-25.2	175.7	-99.1	-106.9	0	0	0	114.4	Y168 A169 N174	Y168-H172 AromaticContact CD2-CD2 3.92Å; Y168-H172 AromaticContact CE2-CD2 3.45Å; Y168-H172 VanDerWaalsContact CE2-CD2 3.45Å; Y168-H172 WeakPolarHBondContact CE2-CD2 3.47Å; Y168-H172 AromaticContact CE2-NE2 3.39Å; Y168-H172 WeakPolarHBondContact CE2-NE2 3.21Å; Y168-H172 AromaticContact CZ-CD2 3.65Å; Y168-H172 AromaticContact CZ-CE1 3.89Å; Y168-H172 AromaticContact CZ-NE2 3.6Å; Y168-H172 PolarHBondContact O-N 2.84Å; Y168-H172 PolarHBondContact OH-CE1 3.32Å; A169-H172 PolarHBondContact O-N 3.3Å; A169-H172 VanDerWaalsContact O-N 3.15Å; H172-N174 VanDerWaalsContact C-N 3.25Å; H172-N174 PolarHBondContact O-N 3.36Å
173	E	53.1	Low	61.7	Low	164 Å²	164	126.8 Å²	126.8	77%	0.766	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-72.3	-12.7	177	-67.7	-168.2	127.7	0	0	114.4	A169	A169-E173 PolarHBondContact O-N 3.41Å
174	N	51	Low	60.8	Low	138 Å²	138	131.7 Å²	131.7	74%	0.738	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-95	6.2	-174.3	-82.9	-58.7	0	0	0	115.9	L170 H172	L170-N174 PolarHBondContact O-ND2 3.28Å; H172-N174 VanDerWaalsContact C-N 3.25Å; H172-N174 PolarHBondContact O-N 3.36Å
175	K	48	Very low	59.7	Low	186 Å²	186	135 Å²	135	81%	0.809	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-95.5	9.6	176	-74.1	-172	177.5	176.4	0	114.9
176	G	49	Very low	58.3	Low	69 Å²	69	136.4 Å²	136.4	71%	0.711	66%	0.664	S	S	*	*	S	Bend	trans	-110.1	15.2	-173.4	0	0	0	0	0	117
177	K	48.4	Very low	57	Low	206 Å²	206	138.9 Å²	138.9	90%	0.896	68%	0.68	S	S	*	*			trans	-136	86.4	177.8	-69.3	-174.8	-177.9	174.8	0	112.5
178	K	37.3	Very low	55.8	Low	285 Å²	285	141.3 Å²	141.3	100%	1.239	70%	0.695	S	S	*	*			trans	-143	0	157.2	-107.9	-170.3	175.8	-175.2	0	108.5

Retrieved 178 of 178 residues in 214 ms (Link to these results)

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