A0A5K4EY98_SCHMA Loading...

Tumor protein p53-inducible protein 11

AlphaFold DB , UniProt , Accession A0A5K4EY98, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 212 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	34.7	Very low	34.6	Very low	247 Å²	247	148.5 Å²	148.5	100%	1.217	76%	0.758	S	S	*	*				0	114.6	0	-83	161.8	141	0	0	107.4
2	S	39.3	Very low	34.1	Very low	85 Å²	85	151.2 Å²	151.2	59%	0.594	76%	0.761	S	S	*	*			cis	-158.1	73.1	1.9	42.5	0	0	0	0	106.8
3	F	37	Very low	33.7	Very low	174 Å²	174	150.8 Å²	150.8	76%	0.763	76%	0.76	S	S	*	*	S	Bend	trans	-94.2	-32.7	174.2	-160.8	-100.2	0	0	0	111.8	Q5 R6 T7	F3-Q5 PolarHBondContact O-N 3.21Å; F3-Q5 VanDerWaalsContact O-N 3.15Å; F3-R6 PolarHBondContact O-N 3.17Å; F3-R6 VanDerWaalsContact O-N 3.13Å; F3-T7 PolarHBondContact O-OG1 2.97Å; F3-T7 VanDerWaalsContact O-OG1 3.1Å
4	L	35.4	Very low	33.4	Very low	156 Å²	156	150.4 Å²	150.4	82%	0.817	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-12.8	176	-86	155.9	0	0	0	114.4
5	Q	37.5	Very low	33.3	Very low	163 Å²	163	154.1 Å²	154.1	76%	0.762	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-9.8	176.2	-141.3	174.8	-9	0	0	113	F3	F3-Q5 PolarHBondContact O-N 3.21Å; F3-Q5 VanDerWaalsContact O-N 3.15Å
6	R	36.5	Very low	32.8	Very low	200 Å²	200	149.2 Å²	149.2	76%	0.755	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-21.6	174.5	-78.7	-171.3	-171.3	-143.9	1.6	114.1	F3 T8 I9	F3-R6 PolarHBondContact O-N 3.17Å; F3-R6 VanDerWaalsContact O-N 3.13Å; R6-T8 VanDerWaalsContact C-N 3.32Å; R6-T8 PolarHBondContact O-N 3.17Å; R6-I9 PolarHBondContact O-N 2.94Å
7	T	34.5	Very low	32.7	Very low	78 Å²	78	148.6 Å²	148.6	48%	0.479	77%	0.768	S	S	.	*	G	3₁₀ helix	trans	-74	-19.7	-170.3	-16.1	0	0	0	0	113.9	F3	F3-T7 PolarHBondContact O-OG1 2.97Å; F3-T7 VanDerWaalsContact O-OG1 3.1Å
8	T	33.3	Very low	32.5	Very low	128 Å²	128	145.3 Å²	145.3	79%	0.785	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-83.9	-8.6	178.2	-32.2	0	0	0	0	113.6	R6	R6-T8 VanDerWaalsContact C-N 3.32Å; R6-T8 PolarHBondContact O-N 3.17Å
9	I	33.4	Very low	32.6	Very low	134 Å²	134	148.8 Å²	148.8	69%	0.687	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-94.5	-3.8	179.5	-64.7	179.2	0	0	0	112.4	R6	R6-I9 PolarHBondContact O-N 2.94Å
10	T	29.4	Very low	32.5	Very low	105 Å²	105	147.6 Å²	147.6	64%	0.644	77%	0.766	S	S	*	*			trans	-116.1	53.4	-178.5	-37.6	0	0	0	0	112.6
11	I	29.6	Very low	32.6	Very low	163 Å²	163	147.2 Å²	147.2	84%	0.836	76%	0.764	S	S	*	*			trans	-119.8	46.7	150.9	-48.2	179.3	0	0	0	108.1
12	F	28.2	Very low	32.3	Very low	181 Å²	181	145.8 Å²	145.8	79%	0.794	75%	0.745	S	S	*	*			trans	-110.3	101	154.3	-90.2	-88.4	0	0	0	105.2
13	I	29.4	Very low	32	Very low	147 Å²	147	147.5 Å²	147.5	75%	0.754	75%	0.747	S	S	*	*	S	Bend	trans	-178.8	120.9	149.4	-89.2	148.2	0	0	0	108.1
14	N	29.1	Very low	32	Very low	145 Å²	145	143.8 Å²	143.8	78%	0.775	74%	0.741	S	S	*	*			trans	68.4	64	152.9	-68.3	-12.6	0	0	0	120.9
15	F	31.6	Very low	31.8	Very low	205 Å²	205	141 Å²	141	90%	0.899	73%	0.727	S	S	*	*			trans	-94.4	107.1	131.5	-95	-86.2	0	0	0	108.2	I17	F15-I17 VanDerWaalsContact C-N 3.3Å; F15-I17 PolarHBondContact O-N 3.22Å
16	G	26.4	Very low	31.6	Very low	76 Å²	76	137.9 Å²	137.9	78%	0.784	72%	0.719	S	S	*	*			trans	-63.6	85	179.2	0	0	0	0	0	111.7	P18	G16-P18 WeakPolarHBondContact O-CD 3.25Å
17	I	31.1	Very low	31.4	Very low	140 Å²	140	133 Å²	133	72%	0.718	71%	0.711	S	S	*	*			trans	-88.1	114.8	166.3	-58.2	176.5	0	0	0	106.6	F15 K19	F15-I17 VanDerWaalsContact C-N 3.3Å; F15-I17 PolarHBondContact O-N 3.22Å; I17-K19 PolarHBondContact O-N 2.92Å
18	P	28.2	Very low	31.1	Very low	88 Å²	88	135.5 Å²	135.5	57%	0.571	72%	0.717	S	S	*	*			trans	-58.4	131.2	-176.5	20.5	-30.1	0	0	0	110.9	G16 T20 L21	G16-P18 WeakPolarHBondContact O-CD 3.25Å; P18-T20 PolarHBondContact O-N 2.79Å; P18-L21 PolarHBondContact O-N 3.13Å
19	K	34.8	Very low	31.1	Very low	212 Å²	212	136.1 Å²	136.1	92%	0.922	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	19.6	-178.3	-84.8	-176.9	173.9	176.9	0	115.6	I17	I17-K19 PolarHBondContact O-N 2.92Å
20	T	31.5	Very low	31.3	Very low	124 Å²	124	137 Å²	137	76%	0.761	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	2.1	-177.4	46.4	0	0	0	0	115.2	P18 R22	P18-T20 PolarHBondContact O-N 2.79Å; T20-R22 PolarHBondContact O-N 3.15Å
21	L	34.5	Very low	31.7	Very low	140 Å²	140	134.2 Å²	134.2	73%	0.733	71%	0.712	S	S	*	*			trans	-80.7	77.8	153	-111.5	115.8	0	0	0	108.1	P18 L23	P18-L21 PolarHBondContact O-N 3.13Å; L21-L23 VanDerWaalsContact C-N 3.31Å; L21-L23 PolarHBondContact O-N 2.99Å
22	R	28.3	Very low	32	Very low	218 Å²	218	133.5 Å²	133.5	82%	0.823	71%	0.71	S	S	*	*			trans	-50.1	107.8	152.4	-69.4	-177.6	-177.4	170.4	1	104.6	T20 P24	T20-R22 PolarHBondContact O-N 3.15Å; R22-P24 VanDerWaalsContact C-N 3.3Å; R22-P24 HydrophobicContact CB-CG 4.34Å; R22-P24 WeakPolarHBondContact O-CD 2.93Å; R22-P24 WeakPolarHBondContact O-CG 3.4Å
23	L	32.1	Very low	32.6	Very low	120 Å²	120	129.3 Å²	129.3	63%	0.628	70%	0.703	S	S	*	*			trans	-67.9	97.8	152.9	-103.2	91	0	0	0	104	L21 N25	L21-L23 VanDerWaalsContact C-N 3.31Å; L21-L23 PolarHBondContact O-N 2.99Å; L23-N25 PolarHBondContact O-N 3.32Å
24	P	37.5	Very low	32.9	Very low	97 Å²	97	125 Å²	125	63%	0.63	68%	0.682	S	S	*	*			trans	-80.7	115.4	-179.8	1.7	21.9	0	0	0	105.1	R22 V26	R22-P24 VanDerWaalsContact C-N 3.3Å; R22-P24 HydrophobicContact CB-CG 4.34Å; R22-P24 WeakPolarHBondContact O-CD 2.93Å; R22-P24 WeakPolarHBondContact O-CG 3.4Å; P24-V26 PolarHBondContact O-N 3.08Å; P24-V26 VanDerWaalsContact O-N 3.09Å
25	N	31.8	Very low	33.3	Very low	98 Å²	98	126.8 Å²	126.8	52%	0.524	69%	0.686	S	S	.	*	S	Bend	trans	69	1.8	155.1	-66.9	-5	0	0	0	121.3	L23 L29	L23-N25 PolarHBondContact O-N 3.32Å; N25-L29 WeakPolarHBondContact O-CB 3.07Å; N25-L29 PolarHBondContact O-N 3.02Å
26	V	32.6	Very low	33.8	Very low	97 Å²	97	118.8 Å²	118.8	59%	0.588	65%	0.653	S	S	*	*	H	α-helix	trans	-73.3	-40.1	174.1	-176.2	0	0	0	0	111.8	P24 L29 L30	P24-V26 PolarHBondContact O-N 3.08Å; P24-V26 VanDerWaalsContact O-N 3.09Å; V26-L29 PolarHBondContact O-N 3.03Å; V26-L30 PolarHBondContact O-N 2.76Å
27	T	31.3	Very low	34.5	Very low	98 Å²	98	124.4 Å²	124.4	60%	0.601	66%	0.656	S	S	*	*	H	α-helix	trans	-75.7	-29.9	178.6	41.1	0	0	0	0	113.1	L30 G31	T27-L30 PolarHBondContact O-N 2.83Å; T27-G31 WeakPolarHBondContact O-CA 3.49Å; T27-G31 PolarHBondContact O-N 2.73Å; T27-G31 VanDerWaalsContact O-N 3.1Å
28	Q	29.7	Very low	35.2	Very low	129 Å²	129	119.8 Å²	119.8	60%	0.603	63%	0.633	S	S	*	*	H	α-helix	trans	-77.3	-27.5	171.8	-88.1	-175.8	-31.3	0	0	113.2	L30 G31	Q28-L30 PolarHBondContact O-N 2.73Å; Q28-G31 PolarHBondContact O-N 3.29Å
29	L	32.9	Very low	36	Very low	142 Å²	142	119.4 Å²	119.4	74%	0.743	63%	0.626	S	S	*	*	H	α-helix	trans	-62.8	-28.3	170.5	-131.2	84.7	0	0	0	112.4	N25 V26	N25-L29 WeakPolarHBondContact O-CB 3.07Å; N25-L29 PolarHBondContact O-N 3.02Å; V26-L29 PolarHBondContact O-N 3.03Å
30	L	36.7	Very low	36.9	Very low	153 Å²	153	115.2 Å²	115.2	80%	0.801	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-8.7	179.8	-74.7	159.6	0	0	0	113.1	V26 T27 Q28	V26-L30 PolarHBondContact O-N 2.76Å; T27-L30 PolarHBondContact O-N 2.83Å; Q28-L30 PolarHBondContact O-N 2.73Å
31	G	37.6	Very low	38.2	Very low	46 Å²	46	117.5 Å²	117.5	47%	0.474	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.6	-38.6	-160.9	0	0	0	0	0	117.1	T27 Q28	T27-G31 WeakPolarHBondContact O-CA 3.49Å; T27-G31 PolarHBondContact O-N 2.73Å; T27-G31 VanDerWaalsContact O-N 3.1Å; Q28-G31 PolarHBondContact O-N 3.29Å
32	D	37	Very low	39.7	Very low	147 Å²	147	113.1 Å²	113.1	79%	0.786	59%	0.592	S	S	*	*	S	Bend	trans	-146.7	-1.6	-156.1	-126.8	-2.9	0	0	0	118.6
33	S	40.2	Very low	41.8	Very low	93 Å²	93	104.7 Å²	104.7	65%	0.65	56%	0.562	S	S	*	*	S	Bend	trans	-121.5	-9.5	-176.1	62.9	0	0	0	0	116.3
34	N	36.2	Very low	44	Very low	58 Å²	58	102.8 Å²	102.8	31%	0.31	56%	0.557	S	S	.	*			trans	-130.8	33.8	178.8	-69.8	-32.3	0	0	0	112.1	V36 L188 Q192	N34-V36 PolarHBondContact O-N 3.47Å; N34-L188 HydrophobicContact CB-CD2 4.44Å; N34-L188 WeakPolarHBondContact OD1-CD2 3.36Å; N34-Q192 PolarHBondContact ND2-OE1 3.1Å; N34-Q192 PolarHBondContact OD1-NE2 3.27Å; N34-Q192 VanDerWaalsContact OD1-NE2 3.12Å
35	E	37.4	Very low	46	Very low	182 Å²	182	100.9 Å²	100.9	85%	0.85	55%	0.546	S	S	*	.			trans	-61.3	78.7	137	-71.6	-163.8	175.9	0	0	105.4	K37	E35-K37 PolarHBondContact O-N 3.26Å; E35-K37 VanDerWaalsContact O-N 3.08Å
36	V	42.5	Very low	48.3	Very low	36 Å²	36	96.2 Å²	96.2	22%	0.218	52%	0.521	C	S	.	.			trans	-34.5	125.1	154.6	175.1	0	0	0	0	102.7	N34 L38 L188	N34-V36 PolarHBondContact O-N 3.47Å; V36-L38 HydrophobicContact CB-CD1 3.82Å; V36-L38 HydrophobicContact CG1-CD1 4.09Å; V36-L38 WeakPolarHBondContact O-CD1 3.27Å; V36-L38 PolarHBondContact O-N 3.36Å; V36-L188 HydrophobicContact CG2-CB 4.06Å; V36-L188 HydrophobicContact CG2-CD2 3.58Å; V36-L188 HydrophobicContact CG2-CG 4.46Å
37	K	39.9	Very low	50.6	Low	194 Å²	194	94.1 Å²	94.1	84%	0.843	51%	0.505	S	S	*	.			trans	-55.1	75.6	156.9	-77	176.9	174.2	179.1	0	105.5	E35	E35-K37 PolarHBondContact O-N 3.26Å; E35-K37 VanDerWaalsContact O-N 3.08Å
38	L	46	Very low	53.2	Low	43 Å²	43	93.5 Å²	93.5	23%	0.225	50%	0.503	C	S	.	.			trans	-46.2	148	156.6	-101	72.2	0	0	0	102.9	V36 I40 I43 M130 I181	V36-L38 HydrophobicContact CB-CD1 3.82Å; V36-L38 HydrophobicContact CG1-CD1 4.09Å; V36-L38 WeakPolarHBondContact O-CD1 3.27Å; V36-L38 PolarHBondContact O-N 3.36Å; L38-I40 WeakPolarHBondContact O-CG1 3.39Å; L38-I40 PolarHBondContact O-N 3.36Å; L38-I43 HydrophobicContact CB-CD1 4.07Å; L38-I43 HydrophobicContact CD2-CD1 3.5Å; L38-I43 VanDerWaalsContact CD2-CD1 3.5Å; L38-I43 HydrophobicContact CD2-CG1 4.23Å; L38-I43 HydrophobicContact CG-CD1 4.43Å; L38-M130 HydrophobicContact CD2-CE 4.13Å; L38-I181 HydrophobicContact CD2-CG2 3.28Å; L38-I181 HydrophobicContact CG-CG2 3.69Å
39	D	45.6	Very low	55.8	Low	80 Å²	80	88.8 Å²	88.8	43%	0.428	48%	0.48	S	S	.	.			trans	-58.8	89.6	166.6	-73.5	-52.6	0	0	0	107	Q41 D42 K184	D39-Q41 PolarHBondContact O-N 2.99Å; D39-D42 PolarHBondContact O-N 3.13Å; D39-K184 IonicContact OD2-NZ 3.26Å; D39-K184 PolarHBondContact OD2-NZ 2.77Å
40	I	53.3	Low	58.3	Low	125 Å²	125	82 Å²	82	64%	0.641	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.5	-178.6	-70.9	166.8	0	0	0	108.7	L38 P44	L38-I40 WeakPolarHBondContact O-CG1 3.39Å; L38-I40 PolarHBondContact O-N 3.36Å; I40-P44 WeakPolarHBondContact O-CD 3.18Å; I40-P44 WeakPolarHBondContact O-CG 3.38Å
41	Q	58.9	Low	60.8	Low	172 Å²	172	78.6 Å²	78.6	80%	0.804	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-32.8	177.2	-159.1	171.3	12.1	0	0	114	D39	D39-Q41 PolarHBondContact O-N 2.99Å
42	D	65.5	Low	63.2	Low	48 Å²	48	80.3 Å²	80.3	26%	0.257	42%	0.419	S	S	.	.	H	α-helix	trans	-82.3	-30.4	-177.9	-86.3	-36.4	0	0	0	112.3	D39 C45 I46 K177 I181	D39-D42 PolarHBondContact O-N 3.13Å; D42-C45 WeakPolarHBondContact O-CB 3.33Å; D42-C45 PolarHBondContact O-N 3.3Å; D42-I46 HydrophobicContact CB-CD1 4.47Å; D42-I46 WeakPolarHBondContact O-CG1 3.37Å; D42-I46 PolarHBondContact O-N 3.46Å; D42-K177 IonicContact OD1-NZ 3.56Å; D42-I181 HydrophobicContact CB-CD1 4.07Å
43	I	72.7	Confident	65.5	Low	40 Å²	40	73.6 Å²	73.6	21%	0.205	38%	0.383	C	S	.	.	H	α-helix	trans	-61.7	-47.4	-176	-53.3	173.3	0	0	0	112.1	L38 C45 I46 H47 M130 I133	L38-I43 HydrophobicContact CB-CD1 4.07Å; L38-I43 HydrophobicContact CD2-CD1 3.5Å; L38-I43 VanDerWaalsContact CD2-CD1 3.5Å; L38-I43 HydrophobicContact CD2-CG1 4.23Å; L38-I43 HydrophobicContact CG-CD1 4.43Å; I43-C45 VanDerWaalsContact C-N 3.25Å; I43-C45 PolarHBondContact O-N 3.14Å; I43-I46 PolarHBondContact O-N 3.41Å; I43-H47 WeakPolarHBondContact O-CB 3.46Å; I43-H47 PolarHBondContact O-N 3.27Å; I43-M130 HydrophobicContact CD1-SD 4.33Å; I43-M130 HydrophobicContact CG2-SD 4.26Å; I43-I133 HydrophobicContact CG2-CD1 4Å
44	P	78.3	Confident	67.8	Low	80 Å²	80	69.2 Å²	69.2	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-35.7	175.7	-23.9	33.6	0	0	0	112.5	I40 H47 C48	I40-P44 WeakPolarHBondContact O-CD 3.18Å; I40-P44 WeakPolarHBondContact O-CG 3.38Å; P44-H47 PolarHBondContact O-N 3.07Å; P44-C48 WeakPolarHBondContact O-CB 3.33Å; P44-C48 PolarHBondContact O-N 3.09Å
45	C	80	Confident	70.2	Confident	57 Å²	57	69.3 Å²	69.3	39%	0.385	36%	0.358	S	S	.	.	H	α-helix	trans	-66.6	-45.3	176.9	-172.9	0	0	0	0	111.2	D42 I43 H47 C48 W49	D42-C45 WeakPolarHBondContact O-CB 3.33Å; D42-C45 PolarHBondContact O-N 3.3Å; I43-C45 VanDerWaalsContact C-N 3.25Å; I43-C45 PolarHBondContact O-N 3.14Å; C45-H47 VanDerWaalsContact C-N 3.32Å; C45-H47 PolarHBondContact O-N 3.47Å; C45-C48 PolarHBondContact O-N 3.24Å; C45-W49 WeakPolarHBondContact O-CB 2.94Å; C45-W49 PolarHBondContact O-N 2.86Å
46	I	80.3	Confident	72.6	Confident	1 Å²	1	63 Å²	63	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-42.3	174.1	-66.2	159.8	0	0	0	110.7	D42 I43 W49 N50 I133 F174 K177 L178 I181	D42-I46 HydrophobicContact CB-CD1 4.47Å; D42-I46 WeakPolarHBondContact O-CG1 3.37Å; D42-I46 PolarHBondContact O-N 3.46Å; I43-I46 PolarHBondContact O-N 3.41Å; I46-W49 PolarHBondContact O-N 3.35Å; I46-N50 PolarHBondContact O-N 2.85Å; I46-N50 PolarHBondContact O-ND2 3.42Å; I46-N50 VanDerWaalsContact O-ND2 3.09Å; I46-I133 HydrophobicContact CG2-CG2 3.62Å; I46-F174 HydrophobicContact CB-CD1 4.4Å; I46-F174 HydrophobicContact CG1-CD1 3.76Å; I46-F174 HydrophobicContact CG1-CE1 4.35Å; I46-K177 HydrophobicContact CD1-CB 4.49Å; I46-L178 HydrophobicContact CD1-CB 4.43Å; I46-L178 HydrophobicContact CD1-CD1 4.18Å; I46-I181 HydrophobicContact CD1-CD1 3.55Å
47	H	81.5	Confident	74.7	Confident	53 Å²	53	61.4 Å²	61.4	25%	0.245	32%	0.32	C	S	.	.	H	α-helix	trans	-64.9	-47.5	179.8	-157.4	-104.5	0	0	0	111.5	I43 P44 C45 W49 N50 Y51 L125	I43-H47 WeakPolarHBondContact O-CB 3.46Å; I43-H47 PolarHBondContact O-N 3.27Å; P44-H47 PolarHBondContact O-N 3.07Å; C45-H47 VanDerWaalsContact C-N 3.32Å; C45-H47 PolarHBondContact O-N 3.47Å; H47-W49 PolarHBondContact O-N 2.85Å; H47-N50 PolarHBondContact O-N 2.84Å; H47-Y51 AromaticContact CE1-CD2 3.91Å; H47-Y51 AromaticContact CE1-CE2 3.12Å; H47-Y51 WeakPolarHBondContact CE1-CE2 3.48Å; H47-Y51 AromaticContact CE1-CZ 3.83Å; H47-Y51 AromaticContact ND1-CD2 3.61Å; H47-Y51 AromaticContact ND1-CE2 3.25Å; H47-Y51 WeakPolarHBondContact ND1-CE2 3.2Å; H47-Y51 WeakPolarHBondContact O-CD2 3.49Å; H47-Y51 PolarHBondContact O-N 2.86Å; H47-L125 PolarHBondContact NE2-O 3.47Å
48	C	85.6	Confident	76.9	Confident	85 Å²	85	55 Å²	55	57%	0.574	29%	0.294	S	S	*	.	H	α-helix	trans	-59.4	-44.8	174.8	-176.3	0	0	0	0	111.8	P44 C45 N50 Y51 L52	P44-C48 WeakPolarHBondContact O-CB 3.33Å; P44-C48 PolarHBondContact O-N 3.09Å; C45-C48 PolarHBondContact O-N 3.24Å; C48-N50 PolarHBondContact O-N 3.34Å; C48-Y51 PolarHBondContact O-N 3.37Å; C48-L52 WeakPolarHBondContact O-CB 3.46Å; C48-L52 PolarHBondContact O-N 3.43Å
49	W	84.9	Confident	78.8	Confident	30 Å²	30	58.6 Å²	58.6	11%	0.114	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-44.1	176.2	179.7	-100	0	0	0	112.4	C45 I46 H47 Y51 L52 M53 L167 I170 T171 F174	C45-W49 WeakPolarHBondContact O-CB 2.94Å; C45-W49 PolarHBondContact O-N 2.86Å; I46-W49 PolarHBondContact O-N 3.35Å; H47-W49 PolarHBondContact O-N 2.85Å; W49-Y51 VanDerWaalsContact C-N 3.33Å; W49-Y51 PolarHBondContact O-N 2.9Å; W49-L52 HydrophobicContact CE3-CD2 3.96Å; W49-L52 HydrophobicContact CZ3-CD2 3.84Å; W49-L52 WeakPolarHBondContact O-CB 3.49Å; W49-L52 PolarHBondContact O-N 3.11Å; W49-M53 HydrophobicContact CD2-CG 4.4Å; W49-M53 HydrophobicContact CH2-SD 4.38Å; W49-M53 HydrophobicContact CZ2-CG 4.01Å; W49-M53 HydrophobicContact CZ2-SD 3.67Å; W49-M53 WeakPolarHBondContact O-CG 3.29Å; W49-M53 PolarHBondContact O-N 3.17Å; W49-L167 HydrophobicContact CH2-CD2 4.07Å; W49-I170 HydrophobicContact CD2-CG2 4.12Å; W49-I170 HydrophobicContact CE3-CG2 4.09Å; W49-I170 HydrophobicContact CH2-CB 3.71Å; W49-I170 HydrophobicContact CH2-CD1 3.87Å; W49-I170 HydrophobicContact CH2-CG1 4.4Å; W49-I170 HydrophobicContact CH2-CG2 3.28Å; W49-I170 HydrophobicContact CZ2-CB 3.59Å; W49-I170 HydrophobicContact CZ2-CG2 3.28Å; W49-I170 HydrophobicContact CZ3-CG2 3.69Å; W49-T171 PolarHBondContact NE1-OG1 2.79Å; W49-F174 HydrophobicContact CB-CD1 4.32Å; W49-F174 HydrophobicContact CB-CD2 3.98Å; W49-F174 HydrophobicContact CB-CE1 4.08Å; W49-F174 HydrophobicContact CB-CE2 3.74Å; W49-F174 HydrophobicContact CB-CG 4.26Å; W49-F174 HydrophobicContact CB-CZ 3.78Å; W49-F174 AromaticContact CD1-CD2 3.31Å; W49-F174 AromaticContact CD1-CE2 3.83Å; W49-F174 AromaticContact CD1-CG 3.76Å; W49-F174 AromaticContact CD2-CD2 3.58Å; W49-F174 HydrophobicContact CD2-CD2 3.58Å; W49-F174 AromaticContact CD2-CE2 3.31Å; W49-F174 HydrophobicContact CD2-CE2 3.31Å; W49-F174 HydrophobicContact CD2-CZ 4.16Å; W49-F174 AromaticContact CE2-CD2 3.76Å; W49-F174 AromaticContact CE2-CE2 3.89Å; W49-F174 HydrophobicContact CE3-CD2 4.38Å; W49-F174 AromaticContact CE3-CE2 3.68Å; W49-F174 HydrophobicContact CE3-CE2 3.68Å; W49-F174 HydrophobicContact CE3-CZ 4.35Å; W49-F174 HydrophobicContact CG-CD1 4.46Å; W49-F174 AromaticContact CG-CD2 3.31Å; W49-F174 HydrophobicContact CG-CD2 3.31Å; W49-F174 HydrophobicContact CG-CE1 4.44Å; W49-F174 AromaticContact CG-CE2 3.31Å; W49-F174 HydrophobicContact CG-CE2 3.31Å; W49-F174 AromaticContact CG-CG 3.93Å; W49-F174 HydrophobicContact CG-CG 3.93Å; W49-F174 AromaticContact CG-CZ 3.9Å; W49-F174 HydrophobicContact CG-CZ 3.9Å; W49-F174 HydrophobicContact CZ3-CE2 4.49Å; W49-F174 AromaticContact NE1-CD2 3.56Å
50	N	84.9	Confident	80.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-35.7	178.1	-72.2	-41.7	0	0	0	112	I46 H47 C48 M53 A54 L125 I133 Q137	I46-N50 PolarHBondContact O-N 2.85Å; I46-N50 PolarHBondContact O-ND2 3.42Å; I46-N50 VanDerWaalsContact O-ND2 3.09Å; H47-N50 PolarHBondContact O-N 2.84Å; C48-N50 PolarHBondContact O-N 3.34Å; N50-M53 PolarHBondContact O-N 3.28Å; N50-A54 WeakPolarHBondContact O-CB 3.19Å; N50-A54 PolarHBondContact O-N 2.8Å; N50-L125 HydrophobicContact CB-CD1 3.84Å; N50-L125 HydrophobicContact CB-CD2 3.63Å; N50-L125 HydrophobicContact CB-CG 4.31Å; N50-I133 WeakPolarHBondContact ND2-CG2 3.36Å; N50-Q137 WeakPolarHBondContact OD1-CG 3.38Å
51	Y	87.9	Confident	81.7	Confident	81 Å²	81	51 Å²	51	32%	0.318	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-41.5	171	-88	-57.7	0	0	0	112.6	H47 C48 W49 A54 S55 L122 L125	H47-Y51 AromaticContact CE1-CD2 3.91Å; H47-Y51 AromaticContact CE1-CE2 3.12Å; H47-Y51 WeakPolarHBondContact CE1-CE2 3.48Å; H47-Y51 AromaticContact CE1-CZ 3.83Å; H47-Y51 AromaticContact ND1-CD2 3.61Å; H47-Y51 AromaticContact ND1-CE2 3.25Å; H47-Y51 WeakPolarHBondContact ND1-CE2 3.2Å; H47-Y51 WeakPolarHBondContact O-CD2 3.49Å; H47-Y51 PolarHBondContact O-N 2.86Å; C48-Y51 PolarHBondContact O-N 3.37Å; W49-Y51 VanDerWaalsContact C-N 3.33Å; W49-Y51 PolarHBondContact O-N 2.9Å; Y51-A54 PolarHBondContact O-N 3.28Å; Y51-S55 WeakPolarHBondContact O-CB 3.22Å; Y51-S55 PolarHBondContact O-N 3.27Å; Y51-S55 PolarHBondContact O-OG 3.38Å; Y51-L122 HydrophobicContact CD1-CD2 3.78Å; Y51-L122 HydrophobicContact CE1-CD2 3.95Å; Y51-L125 HydrophobicContact CD1-CB 4.44Å; Y51-L125 HydrophobicContact CD1-CD1 3.73Å; Y51-L125 HydrophobicContact CD2-CD1 4.48Å; Y51-L125 HydrophobicContact CE1-CB 3.84Å; Y51-L125 HydrophobicContact CE1-CD1 3.98Å; Y51-L125 HydrophobicContact CE2-CB 4.43Å; Y51-L125 HydrophobicContact CG-CD1 3.97Å
52	L	88.4	Confident	82.9	Confident	82 Å²	82	46.3 Å²	46.3	43%	0.429	25%	0.247	S	C	.	.	H	α-helix	trans	-60.4	-48.5	175.1	179.3	64.7	0	0	0	110.5	C48 W49 A54 S55 L56	C48-L52 WeakPolarHBondContact O-CB 3.46Å; C48-L52 PolarHBondContact O-N 3.43Å; W49-L52 HydrophobicContact CE3-CD2 3.96Å; W49-L52 HydrophobicContact CZ3-CD2 3.84Å; W49-L52 WeakPolarHBondContact O-CB 3.49Å; W49-L52 PolarHBondContact O-N 3.11Å; L52-A54 PolarHBondContact O-N 2.7Å; L52-S55 PolarHBondContact O-N 3.38Å; L52-L56 HydrophobicContact CD1-CD1 4.45Å; L52-L56 HydrophobicContact CD1-CG 4.46Å; L52-L56 HydrophobicContact CG-CD1 4.18Å; L52-L56 WeakPolarHBondContact O-CG 3.18Å; L52-L56 PolarHBondContact O-N 3.34Å
53	M	85.8	Confident	83.3	Confident	6 Å²	6	46 Å²	46	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-46.3	176.9	-72.8	-59.3	-64.1	0	0	112	W49 N50 S55 L56 I57 M121 L167	W49-M53 HydrophobicContact CD2-CG 4.4Å; W49-M53 HydrophobicContact CH2-SD 4.38Å; W49-M53 HydrophobicContact CZ2-CG 4.01Å; W49-M53 HydrophobicContact CZ2-SD 3.67Å; W49-M53 WeakPolarHBondContact O-CG 3.29Å; W49-M53 PolarHBondContact O-N 3.17Å; N50-M53 PolarHBondContact O-N 3.28Å; M53-S55 VanDerWaalsContact C-N 3.28Å; M53-S55 PolarHBondContact O-N 3.06Å; M53-L56 PolarHBondContact O-N 3Å; M53-L56 HydrophobicContact SD-CD1 4.39Å; M53-I57 WeakPolarHBondContact O-CG1 3.49Å; M53-I57 PolarHBondContact O-N 2.88Å; M53-M121 HydrophobicContact CB-CE 4.03Å; M53-L167 HydrophobicContact SD-CD2 4.27Å
54	A	87.6	Confident	83.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-41.3	176.5	0	0	0	0	0	111.7	N50 Y51 L52 I57 L58 M121 L122	N50-A54 WeakPolarHBondContact O-CB 3.19Å; N50-A54 PolarHBondContact O-N 2.8Å; Y51-A54 PolarHBondContact O-N 3.28Å; L52-A54 PolarHBondContact O-N 2.7Å; A54-I57 PolarHBondContact O-N 3.28Å; A54-L58 VanDerWaalsContact O-CB 3.31Å; A54-L58 WeakPolarHBondContact O-CB 3.25Å; A54-L58 PolarHBondContact O-N 3Å; A54-M121 HydrophobicContact CB-CB 3.82Å; A54-M121 HydrophobicContact CB-CE 4.1Å; A54-M121 HydrophobicContact CB-SD 4.49Å; A54-L122 HydrophobicContact CB-CD2 3.8Å; A54-L122 HydrophobicContact CB-CG 3.98Å
55	S	88.4	Confident	83.1	Confident	61 Å²	61	43.6 Å²	43.6	43%	0.427	23%	0.231	S	C	.	.	H	α-helix	trans	-67.8	-40.4	178.6	-56.1	0	0	0	0	112.2	Y51 L52 M53 L58 F59	Y51-S55 WeakPolarHBondContact O-CB 3.22Å; Y51-S55 PolarHBondContact O-N 3.27Å; Y51-S55 PolarHBondContact O-OG 3.38Å; L52-S55 PolarHBondContact O-N 3.38Å; M53-S55 VanDerWaalsContact C-N 3.28Å; M53-S55 PolarHBondContact O-N 3.06Å; S55-L58 PolarHBondContact O-N 2.89Å; S55-F59 WeakPolarHBondContact O-CB 3.39Å; S55-F59 PolarHBondContact O-N 3.37Å
56	L	86.5	Confident	82.1	Confident	50 Å²	50	43 Å²	43	26%	0.262	23%	0.234	S	C	.	.	H	α-helix	trans	-63.8	-46.5	175	-72.8	171.6	0	0	0	111.3	L52 M53 L58 F59 F60 L167	L52-L56 HydrophobicContact CD1-CD1 4.45Å; L52-L56 HydrophobicContact CD1-CG 4.46Å; L52-L56 HydrophobicContact CG-CD1 4.18Å; L52-L56 WeakPolarHBondContact O-CG 3.18Å; L52-L56 PolarHBondContact O-N 3.34Å; M53-L56 PolarHBondContact O-N 3Å; M53-L56 HydrophobicContact SD-CD1 4.39Å; L56-L58 VanDerWaalsContact C-N 3.31Å; L56-L58 PolarHBondContact O-N 3.44Å; L56-F59 PolarHBondContact O-N 2.91Å; L56-F60 HydrophobicContact CB-CE2 4.45Å; L56-F60 WeakPolarHBondContact O-CD2 3.25Å; L56-F60 PolarHBondContact O-N 2.99Å; L56-L167 HydrophobicContact CD1-CD1 4.45Å; L56-L167 HydrophobicContact CD1-CD2 4.24Å
57	I	86.3	Confident	80.6	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-41.6	177.6	-63	167	0	0	0	110.3	M53 A54 F60 G61 H114 A118 M121 Y143	M53-I57 WeakPolarHBondContact O-CG1 3.49Å; M53-I57 PolarHBondContact O-N 2.88Å; A54-I57 PolarHBondContact O-N 3.28Å; I57-F60 PolarHBondContact O-N 3.31Å; I57-G61 PolarHBondContact O-N 3.09Å; I57-H114 HydrophobicContact CG2-CB 4.2Å; I57-A118 HydrophobicContact CB-CB 4.21Å; I57-A118 HydrophobicContact CG2-CB 3.97Å; I57-M121 HydrophobicContact CD1-CE 4.37Å; I57-M121 HydrophobicContact CD1-SD 3.59Å; I57-M121 VanDerWaalsContact CD1-SD 3.59Å; I57-Y143 HydrophobicContact CD1-CD1 3.55Å; I57-Y143 HydrophobicContact CD1-CD2 4.49Å; I57-Y143 HydrophobicContact CD1-CE1 3.92Å; I57-Y143 HydrophobicContact CD1-CG 3.88Å; I57-Y143 HydrophobicContact CG1-CD1 3.75Å; I57-Y143 HydrophobicContact CG1-CE1 3.53Å; I57-Y143 HydrophobicContact CG1-CE2 4.4Å; I57-Y143 HydrophobicContact CG1-CG 4.27Å; I57-Y143 HydrophobicContact CG2-CD2 4.11Å; I57-Y143 HydrophobicContact CG2-CE1 4.49Å; I57-Y143 HydrophobicContact CG2-CE2 3.86Å
58	L	87.5	Confident	78.8	Confident	58 Å²	58	52.4 Å²	52.4	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-47.8	175.4	-171.4	71.2	0	0	0	111.2	A54 S55 L56 F60 G61 L62 L115 A118 L122	A54-L58 VanDerWaalsContact O-CB 3.31Å; A54-L58 WeakPolarHBondContact O-CB 3.25Å; A54-L58 PolarHBondContact O-N 3Å; S55-L58 PolarHBondContact O-N 2.89Å; L56-L58 VanDerWaalsContact C-N 3.31Å; L56-L58 PolarHBondContact O-N 3.44Å; L58-F60 PolarHBondContact O-N 3.39Å; L58-G61 PolarHBondContact O-N 2.82Å; L58-L62 HydrophobicContact CG-CD1 4.32Å; L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 2.85Å; L58-L115 HydrophobicContact CD1-CD2 3.77Å; L58-A118 HydrophobicContact CB-CB 3.84Å; L58-A118 HydrophobicContact CD1-CB 3.98Å; L58-L122 HydrophobicContact CD2-CD1 4.46Å
59	F	84.3	Confident	76.9	Confident	120 Å²	120	51.9 Å²	51.9	53%	0.526	28%	0.279	S	S	.	.	H	α-helix	trans	-58.5	-47.5	178.4	178.4	-103.5	0	0	0	111.6	S55 L56 L62 L63	S55-F59 WeakPolarHBondContact O-CB 3.39Å; S55-F59 PolarHBondContact O-N 3.37Å; L56-F59 PolarHBondContact O-N 2.91Å; F59-L62 PolarHBondContact O-N 2.91Å; F59-L63 HydrophobicContact CD1-CD1 3.96Å; F59-L63 HydrophobicContact CE1-CD1 3.46Å; F59-L63 VanDerWaalsContact CE1-CD1 3.46Å; F59-L63 HydrophobicContact CE1-CG 4.32Å; F59-L63 HydrophobicContact CZ-CD1 3.82Å; F59-L63 HydrophobicContact CZ-CG 4.34Å; F59-L63 WeakPolarHBondContact O-CG 3.19Å; F59-L63 PolarHBondContact O-N 2.77Å
60	F	80	Confident	75.3	Confident	44 Å²	44	55.6 Å²	55.6	19%	0.193	31%	0.307	C	S	.	.	H	α-helix	trans	-65.8	-38.4	176.1	-69.9	-53.7	0	0	0	112.9	L56 I57 L58 L62 L63 L64 F75	L56-F60 HydrophobicContact CB-CE2 4.45Å; L56-F60 WeakPolarHBondContact O-CD2 3.25Å; L56-F60 PolarHBondContact O-N 2.99Å; I57-F60 PolarHBondContact O-N 3.31Å; L58-F60 PolarHBondContact O-N 3.39Å; F60-L62 VanDerWaalsContact C-N 3.34Å; F60-L62 PolarHBondContact O-N 3.27Å; F60-L63 HydrophobicContact CD1-CD1 4.24Å; F60-L63 PolarHBondContact O-N 3.42Å; F60-L64 WeakPolarHBondContact O-CG 3.32Å; F60-L64 PolarHBondContact O-N 3.45Å; F60-F75 HydrophobicContact CD1-CE1 4.08Å; F60-F75 AromaticContact CD1-CE2 3.95Å; F60-F75 HydrophobicContact CD1-CE2 3.95Å; F60-F75 AromaticContact CD1-CZ 3.29Å; F60-F75 HydrophobicContact CD1-CZ 3.29Å; F60-F75 AromaticContact CE1-CE2 3.85Å; F60-F75 HydrophobicContact CE1-CE2 3.85Å; F60-F75 AromaticContact CE1-CZ 3.66Å; F60-F75 HydrophobicContact CE1-CZ 3.66Å; F60-F75 HydrophobicContact CG-CZ 4.35Å
61	G	81.6	Confident	73.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.2	-41.6	174.4	0	0	0	0	0	112.8	I57 L58 L64 V65	I57-G61 PolarHBondContact O-N 3.09Å; L58-G61 PolarHBondContact O-N 2.82Å; G61-L64 PolarHBondContact O-N 2.75Å; G61-V65 WeakPolarHBondContact O-CG2 3.38Å; G61-V65 PolarHBondContact O-N 3.47Å
62	L	82.4	Confident	71.8	Confident	75 Å²	75	58.6 Å²	58.6	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-65.4	-40	175.3	-70.7	172.1	0	0	0	112.2	L58 F59 F60 L64 G66 L115	L58-L62 HydrophobicContact CG-CD1 4.32Å; L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 2.85Å; F59-L62 PolarHBondContact O-N 2.91Å; F60-L62 VanDerWaalsContact C-N 3.34Å; F60-L62 PolarHBondContact O-N 3.27Å; L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 2.82Å; L62-G66 PolarHBondContact O-N 3.28Å; L62-L115 HydrophobicContact CD2-CD2 3.99Å; L62-L115 HydrophobicContact CG-CD2 4.04Å
63	L	74.8	Confident	70.3	Confident	41 Å²	41	59.2 Å²	59.2	22%	0.215	33%	0.33	C	S	.	.	H	α-helix	trans	-62	-35	173.9	-71.5	175.2	0	0	0	112.4	F59 F60 F75	F59-L63 HydrophobicContact CD1-CD1 3.96Å; F59-L63 HydrophobicContact CE1-CD1 3.46Å; F59-L63 VanDerWaalsContact CE1-CD1 3.46Å; F59-L63 HydrophobicContact CE1-CG 4.32Å; F59-L63 HydrophobicContact CZ-CD1 3.82Å; F59-L63 HydrophobicContact CZ-CG 4.34Å; F59-L63 WeakPolarHBondContact O-CG 3.19Å; F59-L63 PolarHBondContact O-N 2.77Å; F60-L63 HydrophobicContact CD1-CD1 4.24Å; F60-L63 PolarHBondContact O-N 3.42Å; L63-F75 HydrophobicContact CB-CD1 3.71Å; L63-F75 HydrophobicContact CB-CE1 3.8Å; L63-F75 HydrophobicContact CD1-CD1 4.06Å; L63-F75 HydrophobicContact CD1-CD2 4.35Å; L63-F75 HydrophobicContact CD1-CE1 3.99Å; L63-F75 HydrophobicContact CD1-CE2 4.32Å; L63-F75 HydrophobicContact CD1-CG 4.24Å; L63-F75 HydrophobicContact CD1-CZ 4.16Å; L63-F75 HydrophobicContact CG-CD1 4.49Å
64	L	73.1	Confident	68.9	Low	11 Å²	11	65.5 Å²	65.5	6%	0.058	35%	0.353	C	S	.	.	H	α-helix	trans	-78.3	-41.7	179.9	-72.9	171.7	0	0	0	114.1	F60 G61 L62 G66 F75 L76 L79 L110 H114	F60-L64 WeakPolarHBondContact O-CG 3.32Å; F60-L64 PolarHBondContact O-N 3.45Å; G61-L64 PolarHBondContact O-N 2.75Å; L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 2.82Å; L64-G66 VanDerWaalsContact C-N 3.34Å; L64-F75 HydrophobicContact CD2-CE1 4.45Å; L64-F75 HydrophobicContact CG-CE1 4.46Å; L64-L76 HydrophobicContact CD2-CD2 3.57Å; L64-L79 HydrophobicContact CD2-CD1 3.97Å; L64-L110 HydrophobicContact CD1-CD2 4.22Å; L64-L110 HydrophobicContact CD1-CG 4.14Å; L64-H114 VanDerWaalsContact CD1-CE1 3.5Å; L64-H114 WeakPolarHBondContact CD1-CE1 3.32Å
65	V	73.4	Confident	67.5	Low	59 Å²	59	66.1 Å²	66.1	36%	0.358	36%	0.356	S	S	.	.	H	α-helix	trans	-73.2	-28.6	-178.5	174.4	0	0	0	0	112	G61 G111 L115	G61-V65 WeakPolarHBondContact O-CG2 3.38Å; G61-V65 PolarHBondContact O-N 3.47Å; V65-G111 VanDerWaalsContact CG2-CA 3.5Å; V65-L115 HydrophobicContact CB-CD1 4.41Å; V65-L115 HydrophobicContact CG2-CD1 3.77Å; V65-L115 HydrophobicContact CG2-CG 4.34Å
66	G	60.1	Low	66.1	Low	45 Å²	45	64.4 Å²	64.4	46%	0.464	34%	0.342	S	S	.	.			trans	129.7	114	176.5	0	0	0	0	0	112.1	L62 L64	L62-G66 PolarHBondContact O-N 3.28Å; L64-G66 VanDerWaalsContact C-N 3.34Å
67	F	46.9	Very low	64.7	Low	118 Å²	118	68.1 Å²	68.1	52%	0.518	36%	0.358	S	S	.	.				-102.1	138.1	128.1	-95	-90.9	0	0	0	107.1	I69	F67-I69 HydrophobicContact CB-CB 4.35Å; F67-I69 HydrophobicContact CB-CD1 3.56Å; F67-I69 HydrophobicContact CB-CG1 3.79Å; F67-I69 HydrophobicContact CD1-CD1 3.99Å; F67-I69 HydrophobicContact CD1-CG1 4.44Å; F67-I69 HydrophobicContact CG-CD1 3.93Å; F67-I69 HydrophobicContact CG-CG1 4.49Å; F67-I69 PolarHBondContact O-N 3.38Å
68	P	44.9	Very low	63.4	Low	133 Å²	133	68.9 Å²	68.9	86%	0.864	36%	0.363	S	S	*	.			trans	-72.5	62.9	166.8	33.6	-33.9	0	0	0	108.3
69	I	45	Very low	62	Low	74 Å²	74	67 Å²	67	38%	0.379	35%	0.353	S	S	.	.	S	Bend	trans	-112.2	135.7	170	-62.1	164.3	0	0	0	104.3	F67 H71 S72	F67-I69 HydrophobicContact CB-CB 4.35Å; F67-I69 HydrophobicContact CB-CD1 3.56Å; F67-I69 HydrophobicContact CB-CG1 3.79Å; F67-I69 HydrophobicContact CD1-CD1 3.99Å; F67-I69 HydrophobicContact CD1-CG1 4.44Å; F67-I69 HydrophobicContact CG-CD1 3.93Å; F67-I69 HydrophobicContact CG-CG1 4.49Å; F67-I69 PolarHBondContact O-N 3.38Å; I69-H71 HydrophobicContact CG2-CB 3.98Å; I69-H71 WeakPolarHBondContact CG2-CD2 3.43Å; I69-H71 PolarHBondContact O-N 2.91Å; I69-S72 PolarHBondContact O-N 3.4Å; I69-S72 PolarHBondContact O-OG 3.36Å
70	P	50.9	Low	60.6	Low	107 Å²	107	62.2 Å²	62.2	70%	0.695	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-6.3	176.7	21.1	-34.7	0	0	0	115
71	H	48.8	Very low	59.2	Low	122 Å²	122	61.9 Å²	61.9	57%	0.565	33%	0.334	S	S	*	.	H	α-helix	trans	-80.9	-20.5	175.3	-56.7	-39.6	0	0	0	114.5	I69 W74 F75	I69-H71 HydrophobicContact CG2-CB 3.98Å; I69-H71 WeakPolarHBondContact CG2-CD2 3.43Å; I69-H71 PolarHBondContact O-N 2.91Å; H71-W74 PolarHBondContact O-N 3.25Å; H71-F75 VanDerWaalsContact O-CB 3.31Å; H71-F75 WeakPolarHBondContact O-CB 3.39Å; H71-F75 PolarHBondContact O-N 3.37Å
72	S	52	Low	57.6	Low	22 Å²	22	66.1 Å²	66.1	15%	0.154	36%	0.356	C	S	.	.	H	α-helix	trans	-65.8	-41.8	177.6	58.3	0	0	0	0	111	I69 F75 L76	I69-S72 PolarHBondContact O-N 3.4Å; I69-S72 PolarHBondContact O-OG 3.36Å; S72-F75 PolarHBondContact O-N 3.06Å; S72-L76 VanDerWaalsContact O-CB 3.31Å; S72-L76 WeakPolarHBondContact O-CB 3.32Å; S72-L76 VanDerWaalsContact O-CG 3.26Å; S72-L76 WeakPolarHBondContact O-CG 3.26Å; S72-L76 PolarHBondContact O-N 3.25Å
73	D	56	Low	55.5	Low	95 Å²	95	64.2 Å²	64.2	51%	0.508	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-45.2	175.6	-70.7	-21.3	0	0	0	111.5	L76 Q77	D73-L76 PolarHBondContact O-N 3.24Å; D73-Q77 VanDerWaalsContact O-CB 3.29Å; D73-Q77 WeakPolarHBondContact O-CB 3.31Å; D73-Q77 WeakPolarHBondContact O-CG 3.29Å; D73-Q77 PolarHBondContact O-N 2.81Å
74	W	56.8	Low	53.7	Low	138 Å²	138	69.9 Å²	69.9	52%	0.523	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-43.5	174.8	169.3	80.6	0	0	0	112.3	H71 Q77 S78 W159	H71-W74 PolarHBondContact O-N 3.25Å; W74-Q77 PolarHBondContact O-N 2.98Å; W74-S78 VanDerWaalsContact CE2-OG 3.31Å; W74-S78 PolarHBondContact NE1-OG 3.37Å; W74-S78 VanDerWaalsContact O-CB 3.24Å; W74-S78 WeakPolarHBondContact O-CB 3.18Å; W74-S78 PolarHBondContact O-N 3.33Å; W74-S78 PolarHBondContact O-OG 3.01Å; W74-W159 HydrophobicContact CH2-CZ2 4.25Å; W74-W159 HydrophobicContact CZ2-CZ2 4.47Å
75	F	58.2	Low	51.9	Low	13 Å²	13	76 Å²	76	6%	0.057	41%	0.413	C	S	.	.	H	α-helix	trans	-67.2	-41	-178.6	-179.1	-113.1	0	0	0	111.1	F60 L63 L64 H71 S72 S78 L79	F60-F75 HydrophobicContact CD1-CE1 4.08Å; F60-F75 AromaticContact CD1-CE2 3.95Å; F60-F75 HydrophobicContact CD1-CE2 3.95Å; F60-F75 AromaticContact CD1-CZ 3.29Å; F60-F75 HydrophobicContact CD1-CZ 3.29Å; F60-F75 AromaticContact CE1-CE2 3.85Å; F60-F75 HydrophobicContact CE1-CE2 3.85Å; F60-F75 AromaticContact CE1-CZ 3.66Å; F60-F75 HydrophobicContact CE1-CZ 3.66Å; F60-F75 HydrophobicContact CG-CZ 4.35Å; L63-F75 HydrophobicContact CB-CD1 3.71Å; L63-F75 HydrophobicContact CB-CE1 3.8Å; L63-F75 HydrophobicContact CD1-CD1 4.06Å; L63-F75 HydrophobicContact CD1-CD2 4.35Å; L63-F75 HydrophobicContact CD1-CE1 3.99Å; L63-F75 HydrophobicContact CD1-CE2 4.32Å; L63-F75 HydrophobicContact CD1-CG 4.24Å; L63-F75 HydrophobicContact CD1-CZ 4.16Å; L63-F75 HydrophobicContact CG-CD1 4.49Å; L64-F75 HydrophobicContact CD2-CE1 4.45Å; L64-F75 HydrophobicContact CG-CE1 4.46Å; H71-F75 VanDerWaalsContact O-CB 3.31Å; H71-F75 WeakPolarHBondContact O-CB 3.39Å; H71-F75 PolarHBondContact O-N 3.37Å; S72-F75 PolarHBondContact O-N 3.06Å; F75-S78 PolarHBondContact O-N 3.46Å; F75-L79 HydrophobicContact CD1-CD1 3.68Å; F75-L79 HydrophobicContact CD2-CD1 4.48Å; F75-L79 HydrophobicContact CE1-CD1 3.11Å; F75-L79 HydrophobicContact CE1-CG 4.11Å; F75-L79 HydrophobicContact CE2-CD1 3.99Å; F75-L79 HydrophobicContact CE2-CG 4.12Å; F75-L79 HydrophobicContact CG-CD1 4.33Å; F75-L79 HydrophobicContact CZ-CD1 3.26Å; F75-L79 HydrophobicContact CZ-CD2 4.44Å; F75-L79 HydrophobicContact CZ-CG 3.81Å; F75-L79 WeakPolarHBondContact O-CB 3.24Å; F75-L79 PolarHBondContact O-N 3.39Å
76	L	57.9	Low	50.4	Low	25 Å²	25	79.6 Å²	79.6	13%	0.131	42%	0.421	C	S	.	.	H	α-helix	trans	-63.2	-47.5	173	-75.4	169.6	0	0	0	111.7	L64 S72 D73 S78 L79 F80 Y107	L64-L76 HydrophobicContact CD2-CD2 3.57Å; S72-L76 VanDerWaalsContact O-CB 3.31Å; S72-L76 WeakPolarHBondContact O-CB 3.32Å; S72-L76 VanDerWaalsContact O-CG 3.26Å; S72-L76 WeakPolarHBondContact O-CG 3.26Å; S72-L76 PolarHBondContact O-N 3.25Å; D73-L76 PolarHBondContact O-N 3.24Å; L76-S78 PolarHBondContact O-N 2.96Å; L76-L79 PolarHBondContact O-N 3.28Å; L76-F80 CarbonylContact O-C 3.5Å; L76-F80 WeakPolarHBondContact O-CA 3.38Å; L76-F80 PolarHBondContact O-N 2.78Å; L76-F80 VanDerWaalsContact O-O 3.1Å; L76-Y107 HydrophobicContact CB-CE2 4.33Å; L76-Y107 HydrophobicContact CD1-CD2 3.92Å; L76-Y107 HydrophobicContact CD1-CE2 4.34Å; L76-Y107 HydrophobicContact CD1-CG 4.45Å; L76-Y107 HydrophobicContact CD2-CD1 3.58Å; L76-Y107 HydrophobicContact CD2-CD2 3.46Å; L76-Y107 VanDerWaalsContact CD2-CD2 3.46Å; L76-Y107 HydrophobicContact CD2-CE1 3.93Å; L76-Y107 HydrophobicContact CD2-CE2 3.7Å; L76-Y107 HydrophobicContact CD2-CG 3.37Å; L76-Y107 HydrophobicContact CG-CD2 4.22Å; L76-Y107 HydrophobicContact CG-CE2 4.36Å
77	Q	58.8	Low	49.4	Very low	129 Å²	129	85 Å²	85	60%	0.603	44%	0.439	S	S	*	.	H	α-helix	trans	-62	-30	174	-74.7	174	8	0	0	112.7	D73 W74 F80 P81	D73-Q77 VanDerWaalsContact O-CB 3.29Å; D73-Q77 WeakPolarHBondContact O-CB 3.31Å; D73-Q77 WeakPolarHBondContact O-CG 3.29Å; D73-Q77 PolarHBondContact O-N 2.81Å; W74-Q77 PolarHBondContact O-N 2.98Å; Q77-F80 CarbonylContact C-O 3.2Å; Q77-F80 WeakPolarHBondContact CA-O 3.4Å; Q77-F80 CarbonylContact O-C 3.55Å; Q77-P81 WeakPolarHBondContact O-CA 3.38Å
78	S	59.2	Low	48.9	Very low	17 Å²	17	85.4 Å²	85.4	12%	0.119	45%	0.446	C	S	.	.	H	α-helix	trans	-80.4	-40.9	177.6	-62.8	0	0	0	0	111.9	W74 F75 L76 N158 I160	W74-S78 VanDerWaalsContact CE2-OG 3.31Å; W74-S78 PolarHBondContact NE1-OG 3.37Å; W74-S78 VanDerWaalsContact O-CB 3.24Å; W74-S78 WeakPolarHBondContact O-CB 3.18Å; W74-S78 PolarHBondContact O-N 3.33Å; W74-S78 PolarHBondContact O-OG 3.01Å; F75-S78 PolarHBondContact O-N 3.46Å; L76-S78 PolarHBondContact O-N 2.96Å; S78-N158 PolarHBondContact O-ND2 3.22Å; S78-I160 VanDerWaalsContact C-CD1 3.45Å; S78-I160 WeakPolarHBondContact O-CD1 3.36Å
79	L	57.9	Low	48.4	Very low	18 Å²	18	84 Å²	84	9%	0.094	44%	0.437	C	S	.	.	H	α-helix	trans	-66	-42.9	175.9	-93.6	166.8	0	0	0	111.6	L64 F75 L76 F147 I160	L64-L79 HydrophobicContact CD2-CD1 3.97Å; F75-L79 HydrophobicContact CD1-CD1 3.68Å; F75-L79 HydrophobicContact CD2-CD1 4.48Å; F75-L79 HydrophobicContact CE1-CD1 3.11Å; F75-L79 HydrophobicContact CE1-CG 4.11Å; F75-L79 HydrophobicContact CE2-CD1 3.99Å; F75-L79 HydrophobicContact CE2-CG 4.12Å; F75-L79 HydrophobicContact CG-CD1 4.33Å; F75-L79 HydrophobicContact CZ-CD1 3.26Å; F75-L79 HydrophobicContact CZ-CD2 4.44Å; F75-L79 HydrophobicContact CZ-CG 3.81Å; F75-L79 WeakPolarHBondContact O-CB 3.24Å; F75-L79 PolarHBondContact O-N 3.39Å; L76-L79 PolarHBondContact O-N 3.28Å; L79-F147 HydrophobicContact CD2-CE2 3.99Å; L79-F147 HydrophobicContact CD2-CZ 4.19Å; L79-I160 HydrophobicContact CB-CD1 4.39Å; L79-I160 HydrophobicContact CD2-CD1 4.26Å; L79-I160 HydrophobicContact CD2-CG2 3.64Å; L79-I160 HydrophobicContact CG-CD1 4Å
80	F	55	Low	48.2	Very low	20 Å²	20	86 Å²	86	9%	0.088	45%	0.448	C	S	.	.	S	Bend	trans	-129.6	87.9	178.4	-55.9	-75.5	0	0	0	106.1	L76 Q77 I82 Y107 L110 V150 T154	L76-F80 CarbonylContact O-C 3.5Å; L76-F80 WeakPolarHBondContact O-CA 3.38Å; L76-F80 PolarHBondContact O-N 2.78Å; L76-F80 VanDerWaalsContact O-O 3.1Å; Q77-F80 CarbonylContact C-O 3.2Å; Q77-F80 WeakPolarHBondContact CA-O 3.4Å; Q77-F80 CarbonylContact O-C 3.55Å; F80-I82 PolarHBondContact O-N 3.45Å; F80-Y107 WeakPolarHBondContact CB-OH 3.31Å; F80-Y107 HydrophobicContact CD2-CD1 4.13Å; F80-Y107 AromaticContact CD2-CE1 3.14Å; F80-Y107 HydrophobicContact CD2-CE1 3.14Å; F80-Y107 AromaticContact CD2-CZ 3.56Å; F80-Y107 WeakPolarHBondContact CD2-OH 3.34Å; F80-Y107 AromaticContact CE2-CD1 3.95Å; F80-Y107 HydrophobicContact CE2-CD1 3.95Å; F80-Y107 AromaticContact CE2-CE1 3.29Å; F80-Y107 HydrophobicContact CE2-CE1 3.29Å; F80-Y107 AromaticContact CG-CE1 3.92Å; F80-Y107 HydrophobicContact CG-CE1 3.92Å; F80-Y107 WeakPolarHBondContact CG-OH 3.2Å; F80-Y107 HydrophobicContact CZ-CE1 4.16Å; F80-L110 HydrophobicContact CE2-CD2 4.17Å; F80-L110 HydrophobicContact CZ-CD2 4.05Å; F80-V150 HydrophobicContact CE1-CG1 3.47Å; F80-V150 VanDerWaalsContact CE1-CG1 3.47Å; F80-V150 HydrophobicContact CZ-CG1 3.51Å; F80-T154 HydrophobicContact CD1-CG2 3.72Å; F80-T154 HydrophobicContact CE1-CG2 3.87Å
81	P	49.6	Very low	47.6	Very low	37 Å²	37	85 Å²	85	24%	0.24	44%	0.443	C	S	.	.			trans	-59.3	103.7	160.3	-7.2	20.7	0	0	0	103.5	Q77 S83 Q156 N158	Q77-P81 WeakPolarHBondContact O-CA 3.38Å; P81-S83 PolarHBondContact O-N 3.33Å; P81-Q156 PolarHBondContact O-NE2 3.38Å; P81-Q156 PolarHBondContact O-OE1 2.95Å; P81-N158 WeakPolarHBondContact CD-ND2 3.29Å; P81-N158 WeakPolarHBondContact CG-ND2 3.47Å
82	I	48.3	Very low	47.3	Very low	90 Å²	90	83.4 Å²	83.4	46%	0.462	44%	0.442	S	S	.	.			trans	-66.6	88.9	156.5	-59.1	164.9	0	0	0	100.4	F80 D84 I103	F80-I82 PolarHBondContact O-N 3.45Å; I82-D84 PolarHBondContact O-N 3.45Å; I82-D84 VanDerWaalsContact O-N 3.15Å; I82-I103 HydrophobicContact CD1-CD1 3.83Å; I82-I103 HydrophobicContact CD1-CG2 4.29Å
83	S	38.2	Very low	46.9	Very low	35 Å²	35	91.3 Å²	91.3	25%	0.245	48%	0.477	C	S	.	.			trans	-56.1	128.6	178.1	56.3	0	0	0	0	104.6	P81 N85 Q156	P81-S83 PolarHBondContact O-N 3.33Å; S83-N85 PolarHBondContact O-N 3.27Å; S83-Q156 PolarHBondContact OG-NE2 2.88Å; S83-Q156 VanDerWaalsContact OG-NE2 3.13Å
84	D	37.3	Very low	46.5	Very low	159 Å²	159	92.5 Å²	92.5	85%	0.85	49%	0.493	S	S	*	.	S	Bend	trans	-55.5	1.3	169	-73.7	-40	0	0	0	113	I82 Y86	I82-D84 PolarHBondContact O-N 3.45Å; I82-D84 VanDerWaalsContact O-N 3.15Å; D84-Y86 PolarHBondContact O-N 2.82Å
85	N	36	Very low	45.7	Very low	141 Å²	141	88.5 Å²	88.5	75%	0.754	49%	0.485	S	S	*	.			trans	-72.3	57.7	162.3	-73.4	-12.7	0	0	0	112.7	S83	S83-N85 PolarHBondContact O-N 3.27Å
86	Y	41.3	Very low	45.2	Very low	134 Å²	134	95.9 Å²	95.9	53%	0.525	53%	0.525	S	S	.	.			trans	-146.9	59.4	162.1	-83.8	-79.7	0	0	0	111.2	D84 N88	D84-Y86 PolarHBondContact O-N 2.82Å; Y86-N88 PolarHBondContact O-N 3.03Å; Y86-N88 VanDerWaalsContact O-N 3.17Å
87	D	39	Very low	44.6	Very low	157 Å²	157	99.5 Å²	99.5	84%	0.84	54%	0.544	S	S	*	.			trans	-59.9	-9.9	156.2	-84.4	-30.4	0	0	0	112.5	P89	D87-P89 VanDerWaalsContact O-CD 3.25Å; D87-P89 WeakPolarHBondContact O-CD 3.44Å
88	N	35.3	Very low	43.9	Very low	127 Å²	127	97.4 Å²	97.4	68%	0.679	54%	0.541	S	S	*	.	S	Bend	trans	-93.4	109.3	171.5	-73.5	-25.5	0	0	0	110.4	Y86 I90	Y86-N88 PolarHBondContact O-N 3.03Å; Y86-N88 VanDerWaalsContact O-N 3.17Å; N88-I90 PolarHBondContact O-N 3.13Å
89	P	34.9	Very low	43.4	Very low	104 Å²	104	102.5 Å²	102.5	68%	0.675	56%	0.558	S	S	*	*			trans	-61.4	122.5	166.4	25.6	-31.5	0	0	0	108.4	D87 S91	D87-P89 VanDerWaalsContact O-CD 3.25Å; D87-P89 WeakPolarHBondContact O-CD 3.44Å; P89-S91 PolarHBondContact O-N 2.94Å
90	I	41	Very low	43	Very low	116 Å²	116	105 Å²	105	60%	0.595	58%	0.581	S	S	*	*			trans	-60.4	122.6	159.5	-62.5	172	0	0	0	105.3	N88 T92	N88-I90 PolarHBondContact O-N 3.13Å; I90-T92 PolarHBondContact O-N 2.73Å
91	S	39.1	Very low	42.8	Very low	86 Å²	86	110.8 Å²	110.8	60%	0.601	61%	0.606	S	S	*	*			trans	-55.4	108.7	-176	63.9	0	0	0	0	109.9	P89 E93	P89-S91 PolarHBondContact O-N 2.94Å; S91-E93 PolarHBondContact O-N 3.01Å
92	T	41	Very low	43	Very low	89 Å²	89	112.2 Å²	112.2	55%	0.546	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-79.9	19.7	175.8	49	0	0	0	0	112.4	I90 S94 C95	I90-T92 PolarHBondContact O-N 2.73Å; T92-S94 PolarHBondContact O-N 3.41Å; T92-C95 PolarHBondContact O-N 3.24Å
93	E	44.4	Very low	43.5	Very low	188 Å²	188	110.2 Å²	110.2	88%	0.879	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-56.6	-19.3	178.2	-74.4	-170.1	163.7	0	0	113.1	S91	S91-E93 PolarHBondContact O-N 3.01Å
94	S	47.5	Very low	44.6	Very low	120 Å²	120	114.7 Å²	114.7	84%	0.839	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-107	-1.6	175.6	55.9	0	0	0	0	115.5	T92	T92-S94 PolarHBondContact O-N 3.41Å
95	C	41	Very low	46	Very low	53 Å²	53	113.4 Å²	113.4	36%	0.358	60%	0.603	S	S	.	*			trans	-136.8	98.9	-176.9	-157.9	0	0	0	0	112.2	T92 I97	T92-C95 PolarHBondContact O-N 3.24Å; C95-I97 PolarHBondContact O-N 3.02Å
96	N	46.2	Very low	47.5	Very low	169 Å²	169	111 Å²	111	90%	0.904	59%	0.589	S	S	*	*			trans	-73.3	20.5	179	-83.8	-16.4	0	0	0	114.8
97	I	45.6	Very low	48.8	Very low	101 Å²	101	105.7 Å²	105.7	52%	0.518	57%	0.568	S	S	.	*	S	Bend	trans	-106.5	127.8	179.9	-56.4	176.1	0	0	0	109.2	C95 R99 F101	C95-I97 PolarHBondContact O-N 3.02Å; I97-R99 PolarHBondContact O-N 3.17Å; I97-F101 HydrophobicContact CG2-CB 4.22Å
98	P	44.9	Very low	50.4	Low	85 Å²	85	102.1 Å²	102.1	55%	0.552	55%	0.547	S	S	*	.			trans	-53.6	129.8	177.6	-23.3	31	0	0	0	112.1	A100 F101 N102	P98-A100 VanDerWaalsContact C-N 3.27Å; P98-A100 PolarHBondContact O-N 2.75Å; P98-A100 VanDerWaalsContact O-N 3.13Å; P98-F101 HydrophobicContact CB-CD2 4.25Å; P98-F101 HydrophobicContact CG-CD2 4.47Å; P98-F101 WeakPolarHBondContact O-CB 3.5Å; P98-F101 PolarHBondContact O-N 3.01Å; P98-N102 PolarHBondContact O-N 2.86Å
99	R	48.6	Very low	52.4	Low	124 Å²	124	100.2 Å²	100.2	47%	0.468	53%	0.534	S	S	.	.	H	α-helix	trans	-52.9	-36.8	-172.2	-168.1	177.4	-178.3	-172.2	0.6	114.4	I97 N102 I103	I97-R99 PolarHBondContact O-N 3.17Å; R99-N102 PolarHBondContact O-N 3.12Å; R99-I103 PolarHBondContact O-N 2.99Å
100	A	49.9	Very low	54.3	Low	70 Å²	70	96.6 Å²	96.6	58%	0.579	51%	0.509	S	S	*	.	H	α-helix	trans	-65	-38.9	178.1	0	0	0	0	0	112.8	P98 N102 Q104	P98-A100 VanDerWaalsContact C-N 3.27Å; P98-A100 PolarHBondContact O-N 2.75Å; P98-A100 VanDerWaalsContact O-N 3.13Å; A100-N102 VanDerWaalsContact C-N 3.31Å; A100-N102 PolarHBondContact O-N 3.34Å; A100-Q104 PolarHBondContact O-N 3.36Å
101	F	48.9	Very low	56.2	Low	142 Å²	142	91 Å²	91	62%	0.623	48%	0.481	S	S	*	.	H	α-helix	trans	-64.7	-36.5	174.3	-90.4	-87.8	0	0	0	111.6	I97 P98 Y105	I97-F101 HydrophobicContact CG2-CB 4.22Å; P98-F101 HydrophobicContact CB-CD2 4.25Å; P98-F101 HydrophobicContact CG-CD2 4.47Å; P98-F101 WeakPolarHBondContact O-CB 3.5Å; P98-F101 PolarHBondContact O-N 3.01Å; F101-Y105 WeakPolarHBondContact O-CB 3.36Å; F101-Y105 PolarHBondContact O-N 3.18Å
102	N	55.2	Low	58.3	Low	66 Å²	66	89.8 Å²	89.8	35%	0.353	47%	0.471	S	S	.	.	H	α-helix	trans	-67	-42.7	-177.6	-160.5	3.3	0	0	0	112	P98 R99 A100 Y105 I106	P98-N102 PolarHBondContact O-N 2.86Å; R99-N102 PolarHBondContact O-N 3.12Å; A100-N102 VanDerWaalsContact C-N 3.31Å; A100-N102 PolarHBondContact O-N 3.34Å; N102-Y105 PolarHBondContact O-N 3.17Å; N102-I106 WeakPolarHBondContact O-CD1 3.43Å; N102-I106 VanDerWaalsContact O-CG1 3.25Å; N102-I106 WeakPolarHBondContact O-CG1 3.03Å; N102-I106 PolarHBondContact O-N 3.42Å
103	I	58.1	Low	60.3	Low	48 Å²	48	88.9 Å²	88.9	25%	0.246	46%	0.463	C	S	.	.	H	α-helix	trans	-66.6	-46.7	-179.6	-66.9	176.5	0	0	0	111.2	I82 R99 Y105 I106 Y107	I82-I103 HydrophobicContact CD1-CD1 3.83Å; I82-I103 HydrophobicContact CD1-CG2 4.29Å; R99-I103 PolarHBondContact O-N 2.99Å; I103-Y105 VanDerWaalsContact C-N 3.29Å; I103-Y105 PolarHBondContact O-N 2.99Å; I103-I106 PolarHBondContact O-N 3.48Å; I103-Y107 HydrophobicContact CB-CE2 4.49Å; I103-Y107 HydrophobicContact CG2-CD2 3.61Å; I103-Y107 HydrophobicContact CG2-CE2 3.07Å; I103-Y107 WeakPolarHBondContact O-CD2 3.32Å; I103-Y107 PolarHBondContact O-N 3.45Å
104	Q	62.2	Low	62.3	Low	130 Å²	130	80.4 Å²	80.4	61%	0.607	42%	0.423	S	S	*	.	H	α-helix	trans	-59.8	-40.7	176.2	-73.1	-177.9	-14.2	0	0	111.9	A100 Y107 M108	A100-Q104 PolarHBondContact O-N 3.36Å; Q104-Y107 PolarHBondContact O-N 3.08Å; Q104-M108 WeakPolarHBondContact O-CB 3.49Å; Q104-M108 PolarHBondContact O-N 3.04Å
105	Y	65.2	Low	64.1	Low	131 Å²	131	76.9 Å²	76.9	51%	0.514	39%	0.394	S	S	.	.	H	α-helix	trans	-63.9	-44	177.4	-171.8	-96.4	0	0	0	112.3	F101 N102 I103 Y107 M108 H109	F101-Y105 WeakPolarHBondContact O-CB 3.36Å; F101-Y105 PolarHBondContact O-N 3.18Å; N102-Y105 PolarHBondContact O-N 3.17Å; I103-Y105 VanDerWaalsContact C-N 3.29Å; I103-Y105 PolarHBondContact O-N 2.99Å; Y105-Y107 VanDerWaalsContact C-N 3.33Å; Y105-Y107 PolarHBondContact O-N 2.74Å; Y105-M108 HydrophobicContact CD2-CE 3.88Å; Y105-M108 HydrophobicContact CE2-CE 4Å; Y105-M108 PolarHBondContact O-N 2.81Å; Y105-H109 AromaticContact CD1-CE1 3.73Å; Y105-H109 AromaticContact CD1-ND1 3.66Å; Y105-H109 AromaticContact CD2-CE1 3.8Å; Y105-H109 AromaticContact CE1-CE1 3.19Å; Y105-H109 WeakPolarHBondContact CE1-CE1 3.16Å; Y105-H109 AromaticContact CE1-ND1 3.56Å; Y105-H109 AromaticContact CE1-NE2 3.57Å; Y105-H109 AromaticContact CE2-CE1 3.29Å; Y105-H109 WeakPolarHBondContact CE2-CE1 3.12Å; Y105-H109 AromaticContact CG-ND1 3.95Å; Y105-H109 AromaticContact CZ-CE1 2.96Å; Y105-H109 AromaticContact CZ-ND1 3.77Å; Y105-H109 AromaticContact CZ-NE2 3.39Å; Y105-H109 PolarHBondContact O-N 2.87Å; Y105-H109 PolarHBondContact O-ND1 3.29Å; Y105-H109 PolarHBondContact OH-CE1 3.28Å; Y105-H109 VanDerWaalsContact OH-CE1 3.28Å; Y105-H109 PolarHBondContact OH-NE2 3.48Å
106	I	67.9	Low	66.4	Low	91 Å²	91	79 Å²	79	47%	0.467	41%	0.406	S	S	.	.	H	α-helix	trans	-59.7	-44.4	175.3	-68.5	164	0	0	0	110.5	N102 I103 H109 L110	N102-I106 WeakPolarHBondContact O-CD1 3.43Å; N102-I106 VanDerWaalsContact O-CG1 3.25Å; N102-I106 WeakPolarHBondContact O-CG1 3.03Å; N102-I106 PolarHBondContact O-N 3.42Å; I103-I106 PolarHBondContact O-N 3.48Å; I106-H109 PolarHBondContact O-N 3.02Å; I106-L110 WeakPolarHBondContact O-CB 2.97Å; I106-L110 PolarHBondContact O-N 3.24Å
107	Y	69.2	Low	68.3	Low	23 Å²	23	71.7 Å²	71.7	9%	0.09	37%	0.366	C	S	.	.	H	α-helix	trans	-67.1	-38.7	178	-67.1	-42.5	0	0	0	113.4	L76 F80 I103 Q104 Y105 H109 L110 G111	L76-Y107 HydrophobicContact CB-CE2 4.33Å; L76-Y107 HydrophobicContact CD1-CD2 3.92Å; L76-Y107 HydrophobicContact CD1-CE2 4.34Å; L76-Y107 HydrophobicContact CD1-CG 4.45Å; L76-Y107 HydrophobicContact CD2-CD1 3.58Å; L76-Y107 HydrophobicContact CD2-CD2 3.46Å; L76-Y107 VanDerWaalsContact CD2-CD2 3.46Å; L76-Y107 HydrophobicContact CD2-CE1 3.93Å; L76-Y107 HydrophobicContact CD2-CE2 3.7Å; L76-Y107 HydrophobicContact CD2-CG 3.37Å; L76-Y107 HydrophobicContact CG-CD2 4.22Å; L76-Y107 HydrophobicContact CG-CE2 4.36Å; F80-Y107 WeakPolarHBondContact CB-OH 3.31Å; F80-Y107 HydrophobicContact CD2-CD1 4.13Å; F80-Y107 AromaticContact CD2-CE1 3.14Å; F80-Y107 HydrophobicContact CD2-CE1 3.14Å; F80-Y107 AromaticContact CD2-CZ 3.56Å; F80-Y107 WeakPolarHBondContact CD2-OH 3.34Å; F80-Y107 AromaticContact CE2-CD1 3.95Å; F80-Y107 HydrophobicContact CE2-CD1 3.95Å; F80-Y107 AromaticContact CE2-CE1 3.29Å; F80-Y107 HydrophobicContact CE2-CE1 3.29Å; F80-Y107 AromaticContact CG-CE1 3.92Å; F80-Y107 HydrophobicContact CG-CE1 3.92Å; F80-Y107 WeakPolarHBondContact CG-OH 3.2Å; F80-Y107 HydrophobicContact CZ-CE1 4.16Å; I103-Y107 HydrophobicContact CB-CE2 4.49Å; I103-Y107 HydrophobicContact CG2-CD2 3.61Å; I103-Y107 HydrophobicContact CG2-CE2 3.07Å; I103-Y107 WeakPolarHBondContact O-CD2 3.32Å; I103-Y107 PolarHBondContact O-N 3.45Å; Q104-Y107 PolarHBondContact O-N 3.08Å; Y105-Y107 VanDerWaalsContact C-N 3.33Å; Y105-Y107 PolarHBondContact O-N 2.74Å; Y107-H109 VanDerWaalsContact C-N 3.31Å; Y107-H109 PolarHBondContact O-N 2.89Å; Y107-L110 PolarHBondContact O-N 3Å; Y107-G111 PolarHBondContact O-N 3.2Å
108	M	72.2	Confident	70.4	Confident	82 Å²	82	66.9 Å²	66.9	40%	0.404	34%	0.342	S	S	.	.	H	α-helix	trans	-60.1	-43.5	173.2	-174.5	-175.8	70.8	0	0	110.8	Q104 Y105 G111 C112	Q104-M108 WeakPolarHBondContact O-CB 3.49Å; Q104-M108 PolarHBondContact O-N 3.04Å; Y105-M108 HydrophobicContact CD2-CE 3.88Å; Y105-M108 HydrophobicContact CE2-CE 4Å; Y105-M108 PolarHBondContact O-N 2.81Å; M108-G111 PolarHBondContact O-N 3.37Å; M108-C112 WeakPolarHBondContact O-CB 3.44Å; M108-C112 PolarHBondContact O-N 3.26Å; M108-C112 PolarHBondContact O-SG 2.95Å
109	H	76.4	Confident	72.4	Confident	87 Å²	87	65.9 Å²	65.9	40%	0.403	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-43.1	177.7	-77.1	57.6	0	0	0	112	Y105 I106 Y107 C112 L113	Y105-H109 AromaticContact CD1-CE1 3.73Å; Y105-H109 AromaticContact CD1-ND1 3.66Å; Y105-H109 AromaticContact CD2-CE1 3.8Å; Y105-H109 AromaticContact CE1-CE1 3.19Å; Y105-H109 WeakPolarHBondContact CE1-CE1 3.16Å; Y105-H109 AromaticContact CE1-ND1 3.56Å; Y105-H109 AromaticContact CE1-NE2 3.57Å; Y105-H109 AromaticContact CE2-CE1 3.29Å; Y105-H109 WeakPolarHBondContact CE2-CE1 3.12Å; Y105-H109 AromaticContact CG-ND1 3.95Å; Y105-H109 AromaticContact CZ-CE1 2.96Å; Y105-H109 AromaticContact CZ-ND1 3.77Å; Y105-H109 AromaticContact CZ-NE2 3.39Å; Y105-H109 PolarHBondContact O-N 2.87Å; Y105-H109 PolarHBondContact O-ND1 3.29Å; Y105-H109 PolarHBondContact OH-CE1 3.28Å; Y105-H109 VanDerWaalsContact OH-CE1 3.28Å; Y105-H109 PolarHBondContact OH-NE2 3.48Å; I106-H109 PolarHBondContact O-N 3.02Å; Y107-H109 VanDerWaalsContact C-N 3.31Å; Y107-H109 PolarHBondContact O-N 2.89Å; H109-C112 PolarHBondContact O-N 3.18Å; H109-L113 PolarHBondContact O-N 3.36Å
110	L	76.2	Confident	74.3	Confident	27 Å²	27	61.1 Å²	61.1	14%	0.141	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-45.4	175.5	-175.4	64.4	0	0	0	110.8	L64 F80 I106 Y107 L113 H114 V150	L64-L110 HydrophobicContact CD1-CD2 4.22Å; L64-L110 HydrophobicContact CD1-CG 4.14Å; F80-L110 HydrophobicContact CE2-CD2 4.17Å; F80-L110 HydrophobicContact CZ-CD2 4.05Å; I106-L110 WeakPolarHBondContact O-CB 2.97Å; I106-L110 PolarHBondContact O-N 3.24Å; Y107-L110 PolarHBondContact O-N 3Å; L110-L113 WeakPolarHBondContact O-CB 3.49Å; L110-L113 PolarHBondContact O-N 2.93Å; L110-H114 PolarHBondContact O-N 3.35Å; L110-H114 PolarHBondContact O-ND1 3.4Å; L110-V150 HydrophobicContact CD1-CG2 4.49Å
111	G	80	Confident	76	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-44.2	176.1	0	0	0	0	0	112.4	V65 Y107 M108 L113 H114 L115	V65-G111 VanDerWaalsContact CG2-CA 3.5Å; Y107-G111 PolarHBondContact O-N 3.2Å; M108-G111 PolarHBondContact O-N 3.37Å; G111-L113 VanDerWaalsContact C-N 3.28Å; G111-L113 PolarHBondContact O-N 3.49Å; G111-H114 WeakPolarHBondContact O-CB 3.31Å; G111-H114 PolarHBondContact O-N 3.47Å; G111-H114 VanDerWaalsContact O-N 3.09Å; G111-L115 WeakPolarHBondContact O-CG 3.48Å; G111-L115 PolarHBondContact O-N 3.09Å
112	C	83.7	Confident	77.8	Confident	59 Å²	59	53.4 Å²	53.4	40%	0.399	28%	0.281	S	S	.	.	H	α-helix	trans	-58.5	-41.6	173.6	-74.8	0	0	0	0	111.7	M108 H109 H114 L115 V116	M108-C112 WeakPolarHBondContact O-CB 3.44Å; M108-C112 PolarHBondContact O-N 3.26Å; M108-C112 PolarHBondContact O-SG 2.95Å; H109-C112 PolarHBondContact O-N 3.18Å; C112-H114 VanDerWaalsContact C-N 3.33Å; C112-H114 PolarHBondContact O-N 2.95Å; C112-L115 PolarHBondContact O-N 3.21Å; C112-V116 WeakPolarHBondContact O-CG2 3.49Å; C112-V116 PolarHBondContact O-N 3.45Å
113	L	83.7	Confident	79.3	Confident	71 Å²	71	57.8 Å²	57.8	37%	0.372	29%	0.294	S	S	.	.	H	α-helix	trans	-61.1	-41.1	175	-177.4	65.7	0	0	0	111.8	H109 L110 G111 L115 V116 I117 T146	H109-L113 PolarHBondContact O-N 3.36Å; L110-L113 WeakPolarHBondContact O-CB 3.49Å; L110-L113 PolarHBondContact O-N 2.93Å; G111-L113 VanDerWaalsContact C-N 3.28Å; G111-L113 PolarHBondContact O-N 3.49Å; L113-L115 VanDerWaalsContact C-N 3.34Å; L113-L115 PolarHBondContact O-N 2.98Å; L113-V116 PolarHBondContact O-N 3.23Å; L113-I117 HydrophobicContact CD1-CD1 4.14Å; L113-I117 HydrophobicContact CD1-CG1 4.42Å; L113-I117 HydrophobicContact CG-CD1 3.95Å; L113-I117 VanDerWaalsContact O-CG1 3.31Å; L113-I117 WeakPolarHBondContact O-CG1 3.31Å; L113-I117 PolarHBondContact O-N 3.4Å; L113-T146 HydrophobicContact CD2-CG2 3.86Å
114	H	84.8	Confident	80.5	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.046	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-44.3	174.7	-72.6	55.1	0	0	0	111.2	I57 L64 L110 G111 C112 I117 A118 Y143	I57-H114 HydrophobicContact CG2-CB 4.2Å; L64-H114 VanDerWaalsContact CD1-CE1 3.5Å; L64-H114 WeakPolarHBondContact CD1-CE1 3.32Å; L110-H114 PolarHBondContact O-N 3.35Å; L110-H114 PolarHBondContact O-ND1 3.4Å; G111-H114 WeakPolarHBondContact O-CB 3.31Å; G111-H114 PolarHBondContact O-N 3.47Å; G111-H114 VanDerWaalsContact O-N 3.09Å; C112-H114 VanDerWaalsContact C-N 3.33Å; C112-H114 PolarHBondContact O-N 2.95Å; H114-I117 PolarHBondContact O-N 3Å; H114-A118 VanDerWaalsContact O-CB 3.27Å; H114-A118 WeakPolarHBondContact O-CB 3.44Å; H114-A118 PolarHBondContact O-N 2.87Å; H114-Y143 AromaticContact CD2-CE2 3.44Å; H114-Y143 VanDerWaalsContact CD2-CE2 3.44Å; H114-Y143 WeakPolarHBondContact CD2-CE2 3.39Å; H114-Y143 AromaticContact CD2-CZ 3.74Å; H114-Y143 PolarHBondContact CD2-OH 2.89Å; H114-Y143 AromaticContact CE1-CE2 3.83Å; H114-Y143 AromaticContact CG-CE2 3.86Å; H114-Y143 AromaticContact NE2-CE2 3.43Å; H114-Y143 WeakPolarHBondContact NE2-CE2 3.38Å; H114-Y143 AromaticContact NE2-CZ 3.67Å; H114-Y143 PolarHBondContact NE2-OH 3.5Å
115	L	86.8	Confident	81.5	Confident	46 Å²	46	49.7 Å²	49.7	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-41.2	178.6	-64.1	-179.6	0	0	0	112.3	L58 L62 V65 G111 C112 L113 S119	L58-L115 HydrophobicContact CD1-CD2 3.77Å; L62-L115 HydrophobicContact CD2-CD2 3.99Å; L62-L115 HydrophobicContact CG-CD2 4.04Å; V65-L115 HydrophobicContact CB-CD1 4.41Å; V65-L115 HydrophobicContact CG2-CD1 3.77Å; V65-L115 HydrophobicContact CG2-CG 4.34Å; G111-L115 WeakPolarHBondContact O-CG 3.48Å; G111-L115 PolarHBondContact O-N 3.09Å; C112-L115 PolarHBondContact O-N 3.21Å; L113-L115 VanDerWaalsContact C-N 3.34Å; L113-L115 PolarHBondContact O-N 2.98Å; L115-S119 VanDerWaalsContact O-CB 3.28Å; L115-S119 WeakPolarHBondContact O-CB 3.36Å; L115-S119 PolarHBondContact O-N 3.2Å; L115-S119 PolarHBondContact O-OG 2.93Å
116	V	88.2	Confident	82.1	Confident	98 Å²	98	47.2 Å²	47.2	59%	0.594	26%	0.258	S	S	*	.	H	α-helix	trans	-63.8	-44.6	176.6	171.7	0	0	0	0	111	C112 L113 S119 G120	C112-V116 WeakPolarHBondContact O-CG2 3.49Å; C112-V116 PolarHBondContact O-N 3.45Å; L113-V116 PolarHBondContact O-N 3.23Å; V116-S119 WeakPolarHBondContact CA-OG 3.38Å; V116-S119 PolarHBondContact O-OG 3.34Å; V116-G120 PolarHBondContact O-N 2.9Å
117	I	87	Confident	82.3	Confident	15 Å²	15	47.7 Å²	47.7	8%	0.077	26%	0.259	C	S	.	.	H	α-helix	trans	-65.6	-47.9	178.2	-67.5	169.3	0	0	0	110.6	L113 H114 S119 G120 M121 L139 Y143	L113-I117 HydrophobicContact CD1-CD1 4.14Å; L113-I117 HydrophobicContact CD1-CG1 4.42Å; L113-I117 HydrophobicContact CG-CD1 3.95Å; L113-I117 VanDerWaalsContact O-CG1 3.31Å; L113-I117 WeakPolarHBondContact O-CG1 3.31Å; L113-I117 PolarHBondContact O-N 3.4Å; H114-I117 PolarHBondContact O-N 3Å; I117-S119 PolarHBondContact O-N 3.48Å; I117-G120 PolarHBondContact O-N 2.9Å; I117-M121 HydrophobicContact CG2-CG 4.42Å; I117-M121 HydrophobicContact CG2-SD 4.14Å; I117-M121 WeakPolarHBondContact O-CG 3.42Å; I117-M121 PolarHBondContact O-N 3.32Å; I117-L139 HydrophobicContact CG2-CB 4.26Å; I117-Y143 HydrophobicContact CD1-CD2 3.99Å
118	A	88.8	Confident	81.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-44.6	-179.5	0	0	0	0	0	112.2	I57 L58 H114 M121 L122	I57-A118 HydrophobicContact CB-CB 4.21Å; I57-A118 HydrophobicContact CG2-CB 3.97Å; L58-A118 HydrophobicContact CB-CB 3.84Å; L58-A118 HydrophobicContact CD1-CB 3.98Å; H114-A118 VanDerWaalsContact O-CB 3.27Å; H114-A118 WeakPolarHBondContact O-CB 3.44Å; H114-A118 PolarHBondContact O-N 2.87Å; A118-M121 WeakPolarHBondContact O-CB 3.35Å; A118-M121 PolarHBondContact O-N 2.98Å; A118-L122 WeakPolarHBondContact O-CG 3.45Å; A118-L122 PolarHBondContact O-N 3.49Å
119	S	88.4	Confident	81.4	Confident	64 Å²	64	58.6 Å²	58.6	45%	0.448	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-41.1	175.7	56.7	0	0	0	0	112.1	L115 V116 I117 M121 L122 Y123	L115-S119 VanDerWaalsContact O-CB 3.28Å; L115-S119 WeakPolarHBondContact O-CB 3.36Å; L115-S119 PolarHBondContact O-N 3.2Å; L115-S119 PolarHBondContact O-OG 2.93Å; V116-S119 WeakPolarHBondContact CA-OG 3.38Å; V116-S119 PolarHBondContact O-OG 3.34Å; I117-S119 PolarHBondContact O-N 3.48Å; S119-M121 VanDerWaalsContact C-N 3.32Å; S119-M121 PolarHBondContact O-N 3.46Å; S119-L122 PolarHBondContact O-N 3.42Å; S119-Y123 VanDerWaalsContact O-CB 3.26Å; S119-Y123 WeakPolarHBondContact O-CB 3.27Å; S119-Y123 PolarHBondContact O-N 2.83Å
120	G	86.7	Confident	80.9	Confident	24 Å²	24	57.4 Å²	57.4	25%	0.247	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-42	172.3	0	0	0	0	0	112.5	V116 I117 S124	V116-G120 PolarHBondContact O-N 2.9Å; I117-G120 PolarHBondContact O-N 2.9Å; G120-S124 WeakPolarHBondContact O-CB 3.43Å; G120-S124 PolarHBondContact O-N 2.82Å; G120-S124 PolarHBondContact O-OG 3.23Å
121	M	86.6	Confident	80.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.8	-49.8	175	-73.6	179.9	68.8	0	0	111.3	M53 A54 I57 I117 A118 S119 Y123 S124 L125 L139	M53-M121 HydrophobicContact CB-CE 4.03Å; A54-M121 HydrophobicContact CB-CB 3.82Å; A54-M121 HydrophobicContact CB-CE 4.1Å; A54-M121 HydrophobicContact CB-SD 4.49Å; I57-M121 HydrophobicContact CD1-CE 4.37Å; I57-M121 HydrophobicContact CD1-SD 3.59Å; I57-M121 VanDerWaalsContact CD1-SD 3.59Å; I117-M121 HydrophobicContact CG2-CG 4.42Å; I117-M121 HydrophobicContact CG2-SD 4.14Å; I117-M121 WeakPolarHBondContact O-CG 3.42Å; I117-M121 PolarHBondContact O-N 3.32Å; A118-M121 WeakPolarHBondContact O-CB 3.35Å; A118-M121 PolarHBondContact O-N 2.98Å; S119-M121 VanDerWaalsContact C-N 3.32Å; S119-M121 PolarHBondContact O-N 3.46Å; M121-Y123 PolarHBondContact O-N 3.23Å; M121-S124 WeakPolarHBondContact CA-OG 3.21Å; M121-S124 PolarHBondContact O-N 2.94Å; M121-S124 PolarHBondContact O-OG 3.36Å; M121-L125 VanDerWaalsContact O-CG 3.27Å; M121-L125 WeakPolarHBondContact O-CG 3.43Å; M121-L125 PolarHBondContact O-N 3.5Å; M121-L139 HydrophobicContact CG-CB 3.55Å; M121-L139 HydrophobicContact CG-CD1 3.98Å; M121-L139 HydrophobicContact CG-CG 4.43Å; M121-L139 HydrophobicContact SD-CB 4.34Å
122	L	87.4	Confident	80.2	Confident	50 Å²	50	61.9 Å²	61.9	26%	0.262	33%	0.332	S	S	.	.	H	α-helix	trans	-62.7	-41.1	178.9	-70.4	172.7	0	0	0	112.4	Y51 A54 L58 A118 S119 L125 S126	Y51-L122 HydrophobicContact CD1-CD2 3.78Å; Y51-L122 HydrophobicContact CE1-CD2 3.95Å; A54-L122 HydrophobicContact CB-CD2 3.8Å; A54-L122 HydrophobicContact CB-CG 3.98Å; L58-L122 HydrophobicContact CD2-CD1 4.46Å; A118-L122 WeakPolarHBondContact O-CG 3.45Å; A118-L122 PolarHBondContact O-N 3.49Å; S119-L122 PolarHBondContact O-N 3.42Å; L122-L125 PolarHBondContact O-N 2.84Å; L122-S126 WeakPolarHBondContact O-CB 3.37Å; L122-S126 PolarHBondContact O-N 3.11Å; L122-S126 PolarHBondContact O-OG 2.93Å
123	Y	86.2	Confident	80	Confident	157 Å²	157	59.4 Å²	59.4	62%	0.616	32%	0.315	S	S	*	.	H	α-helix	trans	-61.8	-46.6	175.4	179.3	-100.4	0	0	0	111.1	S119 M121 L125 S126 M127	S119-Y123 VanDerWaalsContact O-CB 3.26Å; S119-Y123 WeakPolarHBondContact O-CB 3.27Å; S119-Y123 PolarHBondContact O-N 2.83Å; M121-Y123 PolarHBondContact O-N 3.23Å; Y123-L125 VanDerWaalsContact C-N 3.34Å; Y123-L125 PolarHBondContact O-N 3.28Å; Y123-S126 WeakPolarHBondContact O-CB 3.43Å; Y123-S126 PolarHBondContact O-N 3.43Å; Y123-M127 HydrophobicContact CE1-CE 4.2Å; Y123-M127 PolarHBondContact O-N 3.47Å; Y123-M127 WeakPolarHBondContact OH-CE 3.48Å
124	S	82.8	Confident	79.7	Confident	6 Å²	6	59 Å²	59	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-37.2	177.5	67.9	0	0	0	0	112.6	G120 M121 S126 M127 G132 S136	G120-S124 WeakPolarHBondContact O-CB 3.43Å; G120-S124 PolarHBondContact O-N 2.82Å; G120-S124 PolarHBondContact O-OG 3.23Å; M121-S124 WeakPolarHBondContact CA-OG 3.21Å; M121-S124 PolarHBondContact O-N 2.94Å; M121-S124 PolarHBondContact O-OG 3.36Å; S124-S126 VanDerWaalsContact C-N 3.32Å; S124-S126 PolarHBondContact O-N 3.05Å; S124-M127 WeakPolarHBondContact O-CB 3.47Å; S124-M127 PolarHBondContact O-N 3.41Å; S124-G132 WeakPolarHBondContact CB-O 3.44Å; S124-G132 CarbonylContact O-C 3.51Å; S124-G132 WeakPolarHBondContact O-CA 3.33Å; S124-G132 PolarHBondContact OG-O 2.94Å; S124-S136 WeakPolarHBondContact OG-CA 3.38Å; S124-S136 VanDerWaalsContact OG-CB 3.27Å; S124-S136 WeakPolarHBondContact OG-CB 3.45Å; S124-S136 PolarHBondContact OG-N 2.75Å
125	L	82.8	Confident	79.4	Confident	3 Å²	3	62 Å²	62	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-71	-27.9	176.6	-69.9	168.2	0	0	0	113.3	H47 N50 Y51 M121 L122 Y123 M127 S136	H47-L125 PolarHBondContact NE2-O 3.47Å; N50-L125 HydrophobicContact CB-CD1 3.84Å; N50-L125 HydrophobicContact CB-CD2 3.63Å; N50-L125 HydrophobicContact CB-CG 4.31Å; Y51-L125 HydrophobicContact CD1-CB 4.44Å; Y51-L125 HydrophobicContact CD1-CD1 3.73Å; Y51-L125 HydrophobicContact CD2-CD1 4.48Å; Y51-L125 HydrophobicContact CE1-CB 3.84Å; Y51-L125 HydrophobicContact CE1-CD1 3.98Å; Y51-L125 HydrophobicContact CE2-CB 4.43Å; Y51-L125 HydrophobicContact CG-CD1 3.97Å; M121-L125 VanDerWaalsContact O-CG 3.27Å; M121-L125 WeakPolarHBondContact O-CG 3.43Å; M121-L125 PolarHBondContact O-N 3.5Å; L122-L125 PolarHBondContact O-N 2.84Å; Y123-L125 VanDerWaalsContact C-N 3.34Å; Y123-L125 PolarHBondContact O-N 3.28Å; L125-M127 VanDerWaalsContact C-N 3.28Å; L125-S136 WeakPolarHBondContact CG-OG 3.49Å
126	S	77.8	Confident	79.1	Confident	79 Å²	79	59.8 Å²	59.8	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-70.8	-25.9	174.6	-60	0	0	0	0	112.1	L122 Y123 S124 I128	L122-S126 WeakPolarHBondContact O-CB 3.37Å; L122-S126 PolarHBondContact O-N 3.11Å; L122-S126 PolarHBondContact O-OG 2.93Å; Y123-S126 WeakPolarHBondContact O-CB 3.43Å; Y123-S126 PolarHBondContact O-N 3.43Å; S124-S126 VanDerWaalsContact C-N 3.32Å; S124-S126 PolarHBondContact O-N 3.05Å; S126-I128 PolarHBondContact O-N 3.19Å; S126-I128 VanDerWaalsContact O-N 3.09Å
127	M	73.6	Confident	78.8	Confident	101 Å²	101	55.4 Å²	55.4	50%	0.498	29%	0.291	S	S	.	.	S	Bend	trans	-72.7	99.6	167.7	-64.6	-69.4	-143.1	0	0	108.4	Y123 S124 L125 K129	Y123-M127 HydrophobicContact CE1-CE 4.2Å; Y123-M127 PolarHBondContact O-N 3.47Å; Y123-M127 WeakPolarHBondContact OH-CE 3.48Å; S124-M127 WeakPolarHBondContact O-CB 3.47Å; S124-M127 PolarHBondContact O-N 3.41Å; L125-M127 VanDerWaalsContact C-N 3.28Å; M127-K129 PolarHBondContact O-N 2.91Å
128	I	56.2	Low	78.6	Confident	168 Å²	168	60.4 Å²	60.4	86%	0.862	32%	0.317	S	S	*	.			trans	-52.1	-18.1	-173.8	-64.6	171.2	0	0	0	114.3	S126	S126-I128 PolarHBondContact O-N 3.19Å; S126-I128 VanDerWaalsContact O-N 3.09Å
129	K	65.4	Low	78.4	Confident	166 Å²	166	62.8 Å²	62.8	72%	0.722	33%	0.33	S	S	*	.	S	Bend	trans	-71	145.6	-178.7	-62.6	-175.4	178	-177.3	0	111.4	M127 N131 G132	M127-K129 PolarHBondContact O-N 2.91Å; K129-N131 PolarHBondContact O-N 3.4Å; K129-G132 PolarHBondContact O-N 3.25Å
130	M	65.3	Low	78.1	Confident	61 Å²	61	59.7 Å²	59.7	30%	0.3	31%	0.308	S	S	.	.	H	α-helix	trans	-46.9	-34	174.7	-73.1	-66.2	-69.9	0	0	113.6	L38 I43 G132 I133 H134 L178 I181	L38-M130 HydrophobicContact CD2-CE 4.13Å; I43-M130 HydrophobicContact CD1-SD 4.33Å; I43-M130 HydrophobicContact CG2-SD 4.26Å; M130-G132 PolarHBondContact O-N 3.39Å; M130-I133 WeakPolarHBondContact O-CB 3.37Å; M130-I133 PolarHBondContact O-N 3.12Å; M130-I133 VanDerWaalsContact O-N 3.08Å; M130-I133 HydrophobicContact SD-CD1 4.09Å; M130-H134 PolarHBondContact O-CD2 2.96Å; M130-H134 PolarHBondContact O-N 3.36Å; M130-L178 HydrophobicContact CE-CD1 3.74Å; M130-I181 HydrophobicContact CE-CG2 4.4Å
131	N	70.9	Confident	77.9	Confident	116 Å²	116	60.5 Å²	60.5	62%	0.62	31%	0.31	S	S	*	.	H	α-helix	trans	-55.2	-34.2	174.9	-65.2	-0.5	0	0	0	113.2	K129 H134 V135	K129-N131 PolarHBondContact O-N 3.4Å; N131-H134 PolarHBondContact O-N 2.85Å; N131-V135 WeakPolarHBondContact O-CG2 3.27Å; N131-V135 PolarHBondContact O-N 2.93Å
132	G	72	Confident	77.5	Confident	5 Å²	5	62.8 Å²	62.8	5%	0.052	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-42.5	175.9	0	0	0	0	0	112.9	S124 K129 M130 H134 V135 S136	S124-G132 WeakPolarHBondContact CB-O 3.44Å; S124-G132 CarbonylContact O-C 3.51Å; S124-G132 WeakPolarHBondContact O-CA 3.33Å; S124-G132 PolarHBondContact OG-O 2.94Å; K129-G132 PolarHBondContact O-N 3.25Å; M130-G132 PolarHBondContact O-N 3.39Å; G132-H134 VanDerWaalsContact C-N 3.31Å; G132-H134 PolarHBondContact O-N 3.26Å; G132-V135 PolarHBondContact O-N 2.97Å; G132-S136 WeakPolarHBondContact O-CB 3.45Å; G132-S136 PolarHBondContact O-N 2.9Å
133	I	77.9	Confident	77.2	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.041	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-42.8	175	-57.3	-177.1	0	0	0	110.4	I43 I46 N50 M130 S136 Q137 L178	I43-I133 HydrophobicContact CG2-CD1 4Å; I46-I133 HydrophobicContact CG2-CG2 3.62Å; N50-I133 WeakPolarHBondContact ND2-CG2 3.36Å; M130-I133 WeakPolarHBondContact O-CB 3.37Å; M130-I133 PolarHBondContact O-N 3.12Å; M130-I133 VanDerWaalsContact O-N 3.08Å; M130-I133 HydrophobicContact SD-CD1 4.09Å; I133-S136 WeakPolarHBondContact O-CB 3.37Å; I133-S136 PolarHBondContact O-N 3.34Å; I133-Q137 WeakPolarHBondContact O-CB 3.34Å; I133-Q137 WeakPolarHBondContact O-CG 3.05Å; I133-Q137 PolarHBondContact O-N 3.4Å; I133-L178 HydrophobicContact CG2-CD1 4.3Å; I133-L178 HydrophobicContact CG2-CD2 3.76Å
134	H	77.3	Confident	76.9	Confident	62 Å²	62	53.9 Å²	53.9	29%	0.287	29%	0.292	S	S	.	.	H	α-helix	trans	-64.2	-44.4	178.5	-67.2	-70.3	0	0	0	112.6	M130 N131 G132 S136 Q137 L138 L178	M130-H134 PolarHBondContact O-CD2 2.96Å; M130-H134 PolarHBondContact O-N 3.36Å; N131-H134 PolarHBondContact O-N 2.85Å; G132-H134 VanDerWaalsContact C-N 3.31Å; G132-H134 PolarHBondContact O-N 3.26Å; H134-S136 VanDerWaalsContact C-N 3.34Å; H134-Q137 PolarHBondContact O-N 3.47Å; H134-L138 WeakPolarHBondContact O-CB 3.49Å; H134-L138 PolarHBondContact O-N 2.9Å; H134-L178 WeakPolarHBondContact CE1-CD2 3.21Å; H134-L178 WeakPolarHBondContact ND1-CD2 3.38Å
135	V	78.9	Confident	76.5	Confident	73 Å²	73	58.5 Å²	58.5	44%	0.442	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-42.1	176.5	173.3	0	0	0	0	110.6	N131 G132 Q137 L138 L139	N131-V135 WeakPolarHBondContact O-CG2 3.27Å; N131-V135 PolarHBondContact O-N 2.93Å; G132-V135 PolarHBondContact O-N 2.97Å; V135-Q137 VanDerWaalsContact C-N 3.34Å; V135-Q137 PolarHBondContact O-N 2.91Å; V135-L138 PolarHBondContact O-N 3.43Å; V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 WeakPolarHBondContact O-CB 3.47Å; V135-L139 WeakPolarHBondContact O-CG 3.31Å; V135-L139 PolarHBondContact O-N 3.45Å
136	S	81.7	Confident	76.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-59.5	-45	175.6	-166.8	0	0	0	0	112	S124 L125 G132 I133 H134 L139 S140	S124-S136 WeakPolarHBondContact OG-CA 3.38Å; S124-S136 VanDerWaalsContact OG-CB 3.27Å; S124-S136 WeakPolarHBondContact OG-CB 3.45Å; S124-S136 PolarHBondContact OG-N 2.75Å; L125-S136 WeakPolarHBondContact CG-OG 3.49Å; G132-S136 WeakPolarHBondContact O-CB 3.45Å; G132-S136 PolarHBondContact O-N 2.9Å; I133-S136 WeakPolarHBondContact O-CB 3.37Å; I133-S136 PolarHBondContact O-N 3.34Å; H134-S136 VanDerWaalsContact C-N 3.34Å; S136-L139 PolarHBondContact O-N 2.92Å; S136-S140 WeakPolarHBondContact O-CB 3.33Å; S136-S140 PolarHBondContact O-N 2.91Å
137	Q	81.7	Confident	75.9	Confident	5 Å²	5	58.2 Å²	58.2	2%	0.023	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-38.2	177.6	-85.1	-164.5	-13.5	0	0	112.8	N50 I133 H134 V135 S140 S141 F174 H175	N50-Q137 WeakPolarHBondContact OD1-CG 3.38Å; I133-Q137 WeakPolarHBondContact O-CB 3.34Å; I133-Q137 WeakPolarHBondContact O-CG 3.05Å; I133-Q137 PolarHBondContact O-N 3.4Å; H134-Q137 PolarHBondContact O-N 3.47Å; V135-Q137 VanDerWaalsContact C-N 3.34Å; V135-Q137 PolarHBondContact O-N 2.91Å; Q137-S140 PolarHBondContact O-N 2.89Å; Q137-S141 PolarHBondContact O-N 3.26Å; Q137-S141 PolarHBondContact O-OG 3.45Å; Q137-F174 PolarHBondContact NE2-O 3.28Å; Q137-H175 VanDerWaalsContact CB-CE1 3.49Å; Q137-H175 WeakPolarHBondContact CB-CE1 3.28Å; Q137-H175 PolarHBondContact O-CE1 3.34Å; Q137-H175 PolarHBondContact O-NE2 2.94Å
138	L	83	Confident	75.8	Confident	121 Å²	121	56.6 Å²	56.6	63%	0.634	31%	0.309	S	S	*	.	H	α-helix	trans	-62.6	-45.3	173.7	-179.2	66.8	0	0	0	111.2	H134 V135 S140 S141 A142	H134-L138 WeakPolarHBondContact O-CB 3.49Å; H134-L138 PolarHBondContact O-N 2.9Å; V135-L138 PolarHBondContact O-N 3.43Å; L138-S140 VanDerWaalsContact C-N 3.34Å; L138-S140 PolarHBondContact O-N 3Å; L138-S141 PolarHBondContact O-N 3.42Å; L138-A142 PolarHBondContact O-N 3.33Å
139	L	83.7	Confident	76.4	Confident	49 Å²	49	50.9 Å²	50.9	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-41.7	176.2	-75.2	171.1	0	0	0	111.8	I117 M121 V135 S136 S141 A142 Y143	I117-L139 HydrophobicContact CG2-CB 4.26Å; M121-L139 HydrophobicContact CG-CB 3.55Å; M121-L139 HydrophobicContact CG-CD1 3.98Å; M121-L139 HydrophobicContact CG-CG 4.43Å; M121-L139 HydrophobicContact SD-CB 4.34Å; V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 WeakPolarHBondContact O-CB 3.47Å; V135-L139 WeakPolarHBondContact O-CG 3.31Å; V135-L139 PolarHBondContact O-N 3.45Å; S136-L139 PolarHBondContact O-N 2.92Å; L139-S141 VanDerWaalsContact C-N 3.34Å; L139-S141 PolarHBondContact O-N 3.45Å; L139-A142 PolarHBondContact O-N 3.33Å; L139-Y143 WeakPolarHBondContact O-CB 3.41Å; L139-Y143 PolarHBondContact O-N 2.88Å
140	S	82.9	Confident	76.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-39.2	174.3	-170.5	0	0	0	0	112.6	S136 Q137 L138 Y143 S144	S136-S140 WeakPolarHBondContact O-CB 3.33Å; S136-S140 PolarHBondContact O-N 2.91Å; Q137-S140 PolarHBondContact O-N 2.89Å; L138-S140 VanDerWaalsContact C-N 3.34Å; L138-S140 PolarHBondContact O-N 3Å; S140-Y143 WeakPolarHBondContact O-CB 3.33Å; S140-Y143 PolarHBondContact O-N 3.36Å; S140-S144 PolarHBondContact O-N 3.42Å; S140-S144 PolarHBondContact O-OG 2.87Å
141	S	81	Confident	76.6	Confident	41 Å²	41	43 Å²	43	29%	0.287	25%	0.253	S	S	.	.	H	α-helix	trans	-68.2	-43	174.3	-65.5	0	0	0	0	112.5	Q137 L138 L139 Y143 S144 V145 H175	Q137-S141 PolarHBondContact O-N 3.26Å; Q137-S141 PolarHBondContact O-OG 3.45Å; L138-S141 PolarHBondContact O-N 3.42Å; L139-S141 VanDerWaalsContact C-N 3.34Å; L139-S141 PolarHBondContact O-N 3.45Å; S141-Y143 VanDerWaalsContact C-N 3.26Å; S141-Y143 PolarHBondContact O-N 3.23Å; S141-S144 WeakPolarHBondContact O-CB 3.38Å; S141-S144 PolarHBondContact O-N 2.84Å; S141-S144 VanDerWaalsContact O-N 3.12Å; S141-V145 WeakPolarHBondContact O-CG2 3.34Å; S141-V145 PolarHBondContact O-N 2.93Å; S141-H175 PolarHBondContact OG-CE1 3.38Å; S141-H175 PolarHBondContact OG-NE2 2.86Å
142	A	79.8	Confident	76.3	Confident	48 Å²	48	43.2 Å²	43.2	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-61.1	-39	176.4	0	0	0	0	0	111.4	L138 L139 V145 T146	L138-A142 PolarHBondContact O-N 3.33Å; L139-A142 PolarHBondContact O-N 3.33Å; A142-V145 PolarHBondContact O-N 2.88Å; A142-T146 PolarHBondContact O-N 3.46Å; A142-T146 PolarHBondContact O-OG1 3.27Å
143	Y	80.6	Confident	75.8	Confident	10 Å²	10	49.8 Å²	49.8	4%	0.039	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-47.4	171.3	180	-108.6	0	0	0	112.3	I57 H114 I117 L139 S140 S141 V145 T146 F147 Y164	I57-Y143 HydrophobicContact CD1-CD1 3.55Å; I57-Y143 HydrophobicContact CD1-CD2 4.49Å; I57-Y143 HydrophobicContact CD1-CE1 3.92Å; I57-Y143 HydrophobicContact CD1-CG 3.88Å; I57-Y143 HydrophobicContact CG1-CD1 3.75Å; I57-Y143 HydrophobicContact CG1-CE1 3.53Å; I57-Y143 HydrophobicContact CG1-CE2 4.4Å; I57-Y143 HydrophobicContact CG1-CG 4.27Å; I57-Y143 HydrophobicContact CG2-CD2 4.11Å; I57-Y143 HydrophobicContact CG2-CE1 4.49Å; I57-Y143 HydrophobicContact CG2-CE2 3.86Å; H114-Y143 AromaticContact CD2-CE2 3.44Å; H114-Y143 VanDerWaalsContact CD2-CE2 3.44Å; H114-Y143 WeakPolarHBondContact CD2-CE2 3.39Å; H114-Y143 AromaticContact CD2-CZ 3.74Å; H114-Y143 PolarHBondContact CD2-OH 2.89Å; H114-Y143 AromaticContact CE1-CE2 3.83Å; H114-Y143 AromaticContact CG-CE2 3.86Å; H114-Y143 AromaticContact NE2-CE2 3.43Å; H114-Y143 WeakPolarHBondContact NE2-CE2 3.38Å; H114-Y143 AromaticContact NE2-CZ 3.67Å; H114-Y143 PolarHBondContact NE2-OH 3.5Å; I117-Y143 HydrophobicContact CD1-CD2 3.99Å; L139-Y143 WeakPolarHBondContact O-CB 3.41Å; L139-Y143 PolarHBondContact O-N 2.88Å; S140-Y143 WeakPolarHBondContact O-CB 3.33Å; S140-Y143 PolarHBondContact O-N 3.36Å; S141-Y143 VanDerWaalsContact C-N 3.26Å; S141-Y143 PolarHBondContact O-N 3.23Å; Y143-V145 VanDerWaalsContact C-N 3.32Å; Y143-V145 PolarHBondContact O-N 3.27Å; Y143-T146 PolarHBondContact O-N 2.94Å; Y143-T146 VanDerWaalsContact O-N 3.13Å; Y143-F147 PolarHBondContact O-N 3.37Å; Y143-Y164 HydrophobicContact CD1-CE2 4.24Å; Y143-Y164 WeakPolarHBondContact CD1-OH 3.34Å; Y143-Y164 AromaticContact CE1-CE2 3.49Å; Y143-Y164 HydrophobicContact CE1-CE2 3.49Å; Y143-Y164 VanDerWaalsContact CE1-CE2 3.49Å; Y143-Y164 AromaticContact CE1-CZ 3.73Å; Y143-Y164 WeakPolarHBondContact CE1-OH 3.43Å; Y143-Y164 PolarHBondContact O-OH 2.99Å
144	S	79.4	Confident	75.1	Confident	10 Å²	10	51.9 Å²	51.9	7%	0.07	30%	0.301	C	S	.	.	H	α-helix	trans	-53.6	-46.6	176.4	-57.6	0	0	0	0	112.6	S140 S141 V148 Y164	S140-S144 PolarHBondContact O-N 3.42Å; S140-S144 PolarHBondContact O-OG 2.87Å; S141-S144 WeakPolarHBondContact O-CB 3.38Å; S141-S144 PolarHBondContact O-N 2.84Å; S141-S144 VanDerWaalsContact O-N 3.12Å; S144-V148 VanDerWaalsContact O-CG2 3.29Å; S144-V148 WeakPolarHBondContact O-CG2 3.45Å; S144-V148 PolarHBondContact O-N 3.46Å; S144-V148 VanDerWaalsContact O-N 3.09Å; S144-Y164 WeakPolarHBondContact CA-OH 3.38Å; S144-Y164 PolarHBondContact N-OH 3.45Å
145	V	75.1	Confident	74.3	Confident	102 Å²	102	57.8 Å²	57.8	62%	0.618	33%	0.326	S	S	*	.	H	α-helix	trans	-65.5	-44.1	177.3	175.2	0	0	0	0	111.6	S141 A142 Y143 F147 V148 A149	S141-V145 WeakPolarHBondContact O-CG2 3.34Å; S141-V145 PolarHBondContact O-N 2.93Å; A142-V145 PolarHBondContact O-N 2.88Å; Y143-V145 VanDerWaalsContact C-N 3.32Å; Y143-V145 PolarHBondContact O-N 3.27Å; V145-F147 VanDerWaalsContact C-N 3.33Å; V145-F147 PolarHBondContact O-N 3.3Å; V145-V148 PolarHBondContact O-N 2.93Å; V145-A149 WeakPolarHBondContact O-CB 3.43Å; V145-A149 PolarHBondContact O-N 3.44Å
146	T	73.4	Confident	73.4	Confident	50 Å²	50	56.6 Å²	56.6	31%	0.307	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-44	-179.1	-55.1	0	0	0	0	111.1	L113 A142 Y143 A149 V150	L113-T146 HydrophobicContact CD2-CG2 3.86Å; A142-T146 PolarHBondContact O-N 3.46Å; A142-T146 PolarHBondContact O-OG1 3.27Å; Y143-T146 PolarHBondContact O-N 2.94Å; Y143-T146 VanDerWaalsContact O-N 3.13Å; T146-A149 PolarHBondContact O-N 2.84Å; T146-V150 WeakPolarHBondContact O-CG2 3.37Å; T146-V150 PolarHBondContact O-N 3.14Å
147	F	73.7	Confident	72.5	Confident	26 Å²	26	63 Å²	63	11%	0.114	35%	0.348	C	S	.	.	H	α-helix	trans	-66.3	-44.5	178.5	-173	-88.6	0	0	0	112.2	L79 Y143 V145 A149 V150 H151 I160 Y164	L79-F147 HydrophobicContact CD2-CE2 3.99Å; L79-F147 HydrophobicContact CD2-CZ 4.19Å; Y143-F147 PolarHBondContact O-N 3.37Å; V145-F147 VanDerWaalsContact C-N 3.33Å; V145-F147 PolarHBondContact O-N 3.3Å; F147-A149 VanDerWaalsContact C-N 3.31Å; F147-A149 PolarHBondContact O-N 3.25Å; F147-V150 PolarHBondContact O-N 3.33Å; F147-H151 WeakPolarHBondContact O-CB 3.44Å; F147-H151 PolarHBondContact O-N 3.31Å; F147-I160 HydrophobicContact CZ-CG2 4.25Å; F147-Y164 HydrophobicContact CB-CD1 4.41Å; F147-Y164 HydrophobicContact CB-CE1 3.63Å; F147-Y164 HydrophobicContact CB-CE2 3.81Å; F147-Y164 WeakPolarHBondContact CB-OH 3.35Å; F147-Y164 AromaticContact CD1-CD1 3.3Å; F147-Y164 HydrophobicContact CD1-CD1 3.3Å; F147-Y164 AromaticContact CD1-CD2 3.58Å; F147-Y164 HydrophobicContact CD1-CD2 3.58Å; F147-Y164 AromaticContact CD1-CE1 3.43Å; F147-Y164 HydrophobicContact CD1-CE1 3.43Å; F147-Y164 VanDerWaalsContact CD1-CE1 3.43Å; F147-Y164 AromaticContact CD1-CE2 3.68Å; F147-Y164 HydrophobicContact CD1-CE2 3.68Å; F147-Y164 AromaticContact CD1-CG 3.37Å; F147-Y164 HydrophobicContact CD1-CG 3.37Å; F147-Y164 AromaticContact CD1-CZ 3.61Å; F147-Y164 HydrophobicContact CD2-CD2 4.09Å; F147-Y164 AromaticContact CD2-CE2 3.78Å; F147-Y164 HydrophobicContact CD2-CE2 3.78Å; F147-Y164 AromaticContact CE1-CD1 3.77Å; F147-Y164 HydrophobicContact CE1-CD1 3.77Å; F147-Y164 AromaticContact CE1-CD2 3.63Å; F147-Y164 HydrophobicContact CE1-CD2 3.63Å; F147-Y164 HydrophobicContact CE1-CE1 4.32Å; F147-Y164 HydrophobicContact CE1-CE2 4.17Å; F147-Y164 AromaticContact CE1-CG 3.39Å; F147-Y164 HydrophobicContact CE1-CG 3.39Å; F147-Y164 HydrophobicContact CE2-CD2 4.14Å; F147-Y164 HydrophobicContact CE2-CE2 4.26Å; F147-Y164 HydrophobicContact CG-CD1 4.03Å; F147-Y164 AromaticContact CG-CD2 3.81Å; F147-Y164 HydrophobicContact CG-CD2 3.81Å; F147-Y164 AromaticContact CG-CE1 3.72Å; F147-Y164 HydrophobicContact CG-CE1 3.72Å; F147-Y164 AromaticContact CG-CE2 3.46Å; F147-Y164 HydrophobicContact CG-CE2 3.46Å; F147-Y164 VanDerWaalsContact CG-CE2 3.46Å; F147-Y164 HydrophobicContact CG-CG 4.07Å; F147-Y164 AromaticContact CG-CZ 3.41Å; F147-Y164 VanDerWaalsContact CG-CZ 3.41Å; F147-Y164 AromaticContact CZ-CD2 3.92Å; F147-Y164 HydrophobicContact CZ-CD2 3.92Å; F147-Y164 HydrophobicContact CZ-CE2 4.44Å; F147-Y164 HydrophobicContact CZ-CG 4.1Å
148	V	71.6	Confident	71.8	Confident	68 Å²	68	64.6 Å²	64.6	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-60.6	-41.3	175.7	170.6	0	0	0	0	111.1	S144 V145 H151 L152	S144-V148 VanDerWaalsContact O-CG2 3.29Å; S144-V148 WeakPolarHBondContact O-CG2 3.45Å; S144-V148 PolarHBondContact O-N 3.46Å; S144-V148 VanDerWaalsContact O-N 3.09Å; V145-V148 PolarHBondContact O-N 2.93Å; V148-H151 PolarHBondContact O-N 3.25Å; V148-L152 HydrophobicContact CG1-CD1 3.96Å; V148-L152 HydrophobicContact CG1-CG 4.26Å; V148-L152 WeakPolarHBondContact O-CB 3.39Å; V148-L152 WeakPolarHBondContact O-CG 3.4Å; V148-L152 PolarHBondContact O-N 3.37Å
149	A	69.3	Low	71.1	Confident	47 Å²	47	65.6 Å²	65.6	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-62	-48	176.7	0	0	0	0	0	111.6	V145 T146 F147 H151 L152 L153	V145-A149 WeakPolarHBondContact O-CB 3.43Å; V145-A149 PolarHBondContact O-N 3.44Å; T146-A149 PolarHBondContact O-N 2.84Å; F147-A149 VanDerWaalsContact C-N 3.31Å; F147-A149 PolarHBondContact O-N 3.25Å; A149-H151 PolarHBondContact O-N 3.45Å; A149-L152 PolarHBondContact O-N 2.91Å; A149-L153 VanDerWaalsContact O-CG 3.27Å; A149-L153 WeakPolarHBondContact O-CG 3.33Å; A149-L153 PolarHBondContact O-N 2.94Å; A149-L153 VanDerWaalsContact O-N 3.14Å
150	V	67	Low	70.4	Confident	37 Å²	37	63.9 Å²	63.9	22%	0.224	34%	0.344	C	S	.	.	H	α-helix	trans	-58.9	-39.4	175.1	168.7	0	0	0	0	110.9	F80 L110 T146 F147 L153 T154	F80-V150 HydrophobicContact CE1-CG1 3.47Å; F80-V150 VanDerWaalsContact CE1-CG1 3.47Å; F80-V150 HydrophobicContact CZ-CG1 3.51Å; L110-V150 HydrophobicContact CD1-CG2 4.49Å; T146-V150 WeakPolarHBondContact O-CG2 3.37Å; T146-V150 PolarHBondContact O-N 3.14Å; F147-V150 PolarHBondContact O-N 3.33Å; V150-L153 PolarHBondContact O-N 3.28Å; V150-T154 WeakPolarHBondContact O-CG2 3.26Å; V150-T154 PolarHBondContact O-N 3.08Å; V150-T154 PolarHBondContact O-OG1 3.04Å
151	H	67.6	Low	69.7	Low	24 Å²	24	64.8 Å²	64.8	11%	0.111	35%	0.349	C	S	.	.	H	α-helix	trans	-69.9	-44.4	179.5	-165.9	64.5	0	0	0	114.2	F147 V148 A149 L153 T154 K155 Q156 V161	F147-H151 WeakPolarHBondContact O-CB 3.44Å; F147-H151 PolarHBondContact O-N 3.31Å; V148-H151 PolarHBondContact O-N 3.25Å; A149-H151 PolarHBondContact O-N 3.45Å; H151-L153 PolarHBondContact O-N 3.35Å; H151-T154 PolarHBondContact O-N 3.34Å; H151-T154 PolarHBondContact O-OG1 3.43Å; H151-T154 VanDerWaalsContact O-OG1 3.09Å; H151-K155 PolarHBondContact O-N 2.72Å; H151-Q156 PolarHBondContact CE1-O 3.02Å; H151-Q156 PolarHBondContact NE2-O 2.9Å; H151-V161 WeakPolarHBondContact CE1-CG2 3.48Å; H151-V161 WeakPolarHBondContact ND1-CG2 3.42Å; H151-V161 WeakPolarHBondContact NE2-CG2 3.47Å
152	L	65.3	Low	69.3	Low	121 Å²	121	70.1 Å²	70.1	63%	0.634	36%	0.364	S	S	*	.	H	α-helix	trans	-60.8	-33.1	176	-75	173.4	0	0	0	111.7	V148 A149 K155	V148-L152 HydrophobicContact CG1-CD1 3.96Å; V148-L152 HydrophobicContact CG1-CG 4.26Å; V148-L152 WeakPolarHBondContact O-CB 3.39Å; V148-L152 WeakPolarHBondContact O-CG 3.4Å; V148-L152 PolarHBondContact O-N 3.37Å; A149-L152 PolarHBondContact O-N 2.91Å; L152-K155 WeakPolarHBondContact O-CG 3.23Å
153	L	61.6	Low	69	Low	143 Å²	143	71.6 Å²	71.6	75%	0.749	37%	0.365	S	S	*	.	H	α-helix	trans	-67.6	-35.9	174.7	-70.9	168.8	0	0	0	112.2	A149 V150 H151	A149-L153 VanDerWaalsContact O-CG 3.27Å; A149-L153 WeakPolarHBondContact O-CG 3.33Å; A149-L153 PolarHBondContact O-N 2.94Å; A149-L153 VanDerWaalsContact O-N 3.14Å; V150-L153 PolarHBondContact O-N 3.28Å; H151-L153 PolarHBondContact O-N 3.35Å
154	T	63.4	Low	68.6	Low	53 Å²	53	72 Å²	72	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-86	-14.3	-178.4	60.1	0	0	0	0	114.1	F80 V150 H151 Q156	F80-T154 HydrophobicContact CD1-CG2 3.72Å; F80-T154 HydrophobicContact CE1-CG2 3.87Å; V150-T154 WeakPolarHBondContact O-CG2 3.26Å; V150-T154 PolarHBondContact O-N 3.08Å; V150-T154 PolarHBondContact O-OG1 3.04Å; H151-T154 PolarHBondContact O-N 3.34Å; H151-T154 PolarHBondContact O-OG1 3.43Å; H151-T154 VanDerWaalsContact O-OG1 3.09Å; T154-Q156 PolarHBondContact O-N 2.89Å; T154-Q156 VanDerWaalsContact O-N 3.08Å
155	K	59.5	Low	68.3	Low	186 Å²	186	74.8 Å²	74.8	81%	0.809	38%	0.383	S	S	*	.			trans	55.7	21.3	171.7	-62.7	-172.7	177.9	-179.4	0	115.7	H151 L152	H151-K155 PolarHBondContact O-N 2.72Å; L152-K155 WeakPolarHBondContact O-CG 3.23Å
156	Q	60.2	Low	68.4	Low	47 Å²	47	73.8 Å²	73.8	22%	0.22	38%	0.377	C	S	.	.			trans	-118.9	106.6	-175.9	-75.7	-172.9	11.3	0	0	112.9	P81 S83 H151 T154 N158	P81-Q156 PolarHBondContact O-NE2 3.38Å; P81-Q156 PolarHBondContact O-OE1 2.95Å; S83-Q156 PolarHBondContact OG-NE2 2.88Å; S83-Q156 VanDerWaalsContact OG-NE2 3.13Å; H151-Q156 PolarHBondContact CE1-O 3.02Å; H151-Q156 PolarHBondContact NE2-O 2.9Å; T154-Q156 PolarHBondContact O-N 2.89Å; T154-Q156 VanDerWaalsContact O-N 3.08Å; Q156-N158 PolarHBondContact O-N 2.87Å
157	L	63.1	Low	68.6	Low	134 Å²	134	72.7 Å²	72.7	70%	0.702	37%	0.369	S	S	*	.			trans	-69.5	113.4	177.5	-68.2	169	0	0	0	111.2
158	N	67.2	Low	68.7	Low	39 Å²	39	72.9 Å²	72.9	21%	0.209	37%	0.373	C	S	.	.			trans	-121.1	161.3	176.4	-95.8	-3.1	0	0	0	112.7	S78 P81 Q156 I160 V161 Y162	S78-N158 PolarHBondContact O-ND2 3.22Å; P81-N158 WeakPolarHBondContact CD-ND2 3.29Å; P81-N158 WeakPolarHBondContact CG-ND2 3.47Å; Q156-N158 PolarHBondContact O-N 2.87Å; N158-I160 PolarHBondContact O-N 2.92Å; N158-I160 VanDerWaalsContact O-N 3.11Å; N158-V161 HydrophobicContact CB-CG2 4.17Å; N158-V161 WeakPolarHBondContact O-CA 3.48Å; N158-V161 WeakPolarHBondContact O-CB 3.27Å; N158-V161 VanDerWaalsContact O-CG2 3.25Å; N158-V161 WeakPolarHBondContact O-CG2 3.43Å; N158-V161 PolarHBondContact O-N 3.26Å; N158-Y162 WeakPolarHBondContact O-CD2 3.42Å; N158-Y162 PolarHBondContact O-N 2.9Å
159	W	68.2	Low	69	Low	143 Å²	143	74 Å²	74	54%	0.542	38%	0.376	S	S	.	.	H	α-helix	trans	-54.8	-30.8	176.2	67.9	-94.5	0	0	0	112.8	W74 V161 Y162 L163	W74-W159 HydrophobicContact CH2-CZ2 4.25Å; W74-W159 HydrophobicContact CZ2-CZ2 4.47Å; W159-V161 VanDerWaalsContact C-N 3.27Å; W159-V161 PolarHBondContact O-N 2.99Å; W159-Y162 WeakPolarHBondContact O-CB 3.27Å; W159-Y162 PolarHBondContact O-N 3.27Å; W159-L163 HydrophobicContact CZ3-CD2 4.4Å; W159-L163 PolarHBondContact O-N 3.47Å
160	I	68.2	Low	69.5	Low	12 Å²	12	74.3 Å²	74.3	6%	0.062	37%	0.37	C	S	.	.	H	α-helix	trans	-63.1	-34.6	175.9	-64.4	164.2	0	0	0	111.6	S78 L79 F147 N158 L163 Y164	S78-I160 VanDerWaalsContact C-CD1 3.45Å; S78-I160 WeakPolarHBondContact O-CD1 3.36Å; L79-I160 HydrophobicContact CB-CD1 4.39Å; L79-I160 HydrophobicContact CD2-CD1 4.26Å; L79-I160 HydrophobicContact CD2-CG2 3.64Å; L79-I160 HydrophobicContact CG-CD1 4Å; F147-I160 HydrophobicContact CZ-CG2 4.25Å; N158-I160 PolarHBondContact O-N 2.92Å; N158-I160 VanDerWaalsContact O-N 3.11Å; I160-L163 PolarHBondContact O-N 3.49Å; I160-Y164 WeakPolarHBondContact O-CB 3.37Å; I160-Y164 PolarHBondContact O-N 3.09Å
161	V	68.7	Low	70	Confident	20 Å²	20	72.7 Å²	72.7	12%	0.121	36%	0.36	C	S	.	.	H	α-helix	trans	-68.1	-41.3	177.8	-168.4	0	0	0	0	110.6	H151 N158 W159 Y164 T165	H151-V161 WeakPolarHBondContact CE1-CG2 3.48Å; H151-V161 WeakPolarHBondContact ND1-CG2 3.42Å; H151-V161 WeakPolarHBondContact NE2-CG2 3.47Å; N158-V161 HydrophobicContact CB-CG2 4.17Å; N158-V161 WeakPolarHBondContact O-CA 3.48Å; N158-V161 WeakPolarHBondContact O-CB 3.27Å; N158-V161 VanDerWaalsContact O-CG2 3.25Å; N158-V161 WeakPolarHBondContact O-CG2 3.43Å; N158-V161 PolarHBondContact O-N 3.26Å; W159-V161 VanDerWaalsContact C-N 3.27Å; W159-V161 PolarHBondContact O-N 2.99Å; V161-Y164 PolarHBondContact O-N 3.27Å; V161-T165 WeakPolarHBondContact O-CB 3.35Å; V161-T165 PolarHBondContact O-N 3.47Å; V161-T165 PolarHBondContact O-OG1 2.91Å
162	Y	72.8	Confident	70.5	Confident	152 Å²	152	76 Å²	76	60%	0.596	38%	0.377	S	S	*	.	H	α-helix	trans	-61.4	-47.6	174.9	-72.9	-78.5	0	0	0	110.6	N158 W159 Y164 T165 V166	N158-Y162 WeakPolarHBondContact O-CD2 3.42Å; N158-Y162 PolarHBondContact O-N 2.9Å; W159-Y162 WeakPolarHBondContact O-CB 3.27Å; W159-Y162 PolarHBondContact O-N 3.27Å; Y162-Y164 VanDerWaalsContact C-N 3.29Å; Y162-Y164 PolarHBondContact O-N 3.46Å; Y162-T165 PolarHBondContact O-N 3.44Å; Y162-V166 WeakPolarHBondContact O-CG2 3.47Å; Y162-V166 PolarHBondContact O-N 3Å
163	L	72.8	Confident	71.2	Confident	80 Å²	80	74.4 Å²	74.4	42%	0.419	37%	0.369	S	S	.	.	H	α-helix	trans	-56.9	-45	175	-176.3	67.9	0	0	0	111.2	W159 I160 V166 L167	W159-L163 HydrophobicContact CZ3-CD2 4.4Å; W159-L163 PolarHBondContact O-N 3.47Å; I160-L163 PolarHBondContact O-N 3.49Å; L163-V166 PolarHBondContact O-N 2.95Å; L163-L167 HydrophobicContact CG-CD1 4.43Å; L163-L167 WeakPolarHBondContact O-CG 3.42Å; L163-L167 PolarHBondContact O-N 2.98Å
164	Y	72.5	Confident	72	Confident	19 Å²	19	68.6 Å²	68.6	8%	0.075	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-40.5	179.1	-160.9	-89.8	0	0	0	113.3	Y143 S144 F147 I160 V161 Y162 V166 L167 T168	Y143-Y164 HydrophobicContact CD1-CE2 4.24Å; Y143-Y164 WeakPolarHBondContact CD1-OH 3.34Å; Y143-Y164 AromaticContact CE1-CE2 3.49Å; Y143-Y164 HydrophobicContact CE1-CE2 3.49Å; Y143-Y164 VanDerWaalsContact CE1-CE2 3.49Å; Y143-Y164 AromaticContact CE1-CZ 3.73Å; Y143-Y164 WeakPolarHBondContact CE1-OH 3.43Å; Y143-Y164 PolarHBondContact O-OH 2.99Å; S144-Y164 WeakPolarHBondContact CA-OH 3.38Å; S144-Y164 PolarHBondContact N-OH 3.45Å; F147-Y164 HydrophobicContact CB-CD1 4.41Å; F147-Y164 HydrophobicContact CB-CE1 3.63Å; F147-Y164 HydrophobicContact CB-CE2 3.81Å; F147-Y164 WeakPolarHBondContact CB-OH 3.35Å; F147-Y164 AromaticContact CD1-CD1 3.3Å; F147-Y164 HydrophobicContact CD1-CD1 3.3Å; F147-Y164 AromaticContact CD1-CD2 3.58Å; F147-Y164 HydrophobicContact CD1-CD2 3.58Å; F147-Y164 AromaticContact CD1-CE1 3.43Å; F147-Y164 HydrophobicContact CD1-CE1 3.43Å; F147-Y164 VanDerWaalsContact CD1-CE1 3.43Å; F147-Y164 AromaticContact CD1-CE2 3.68Å; F147-Y164 HydrophobicContact CD1-CE2 3.68Å; F147-Y164 AromaticContact CD1-CG 3.37Å; F147-Y164 HydrophobicContact CD1-CG 3.37Å; F147-Y164 AromaticContact CD1-CZ 3.61Å; F147-Y164 HydrophobicContact CD2-CD2 4.09Å; F147-Y164 AromaticContact CD2-CE2 3.78Å; F147-Y164 HydrophobicContact CD2-CE2 3.78Å; F147-Y164 AromaticContact CE1-CD1 3.77Å; F147-Y164 HydrophobicContact CE1-CD1 3.77Å; F147-Y164 AromaticContact CE1-CD2 3.63Å; F147-Y164 HydrophobicContact CE1-CD2 3.63Å; F147-Y164 HydrophobicContact CE1-CE1 4.32Å; F147-Y164 HydrophobicContact CE1-CE2 4.17Å; F147-Y164 AromaticContact CE1-CG 3.39Å; F147-Y164 HydrophobicContact CE1-CG 3.39Å; F147-Y164 HydrophobicContact CE2-CD2 4.14Å; F147-Y164 HydrophobicContact CE2-CE2 4.26Å; F147-Y164 HydrophobicContact CG-CD1 4.03Å; F147-Y164 AromaticContact CG-CD2 3.81Å; F147-Y164 HydrophobicContact CG-CD2 3.81Å; F147-Y164 AromaticContact CG-CE1 3.72Å; F147-Y164 HydrophobicContact CG-CE1 3.72Å; F147-Y164 AromaticContact CG-CE2 3.46Å; F147-Y164 HydrophobicContact CG-CE2 3.46Å; F147-Y164 VanDerWaalsContact CG-CE2 3.46Å; F147-Y164 HydrophobicContact CG-CG 4.07Å; F147-Y164 AromaticContact CG-CZ 3.41Å; F147-Y164 VanDerWaalsContact CG-CZ 3.41Å; F147-Y164 AromaticContact CZ-CD2 3.92Å; F147-Y164 HydrophobicContact CZ-CD2 3.92Å; F147-Y164 HydrophobicContact CZ-CE2 4.44Å; F147-Y164 HydrophobicContact CZ-CG 4.1Å; I160-Y164 WeakPolarHBondContact O-CB 3.37Å; I160-Y164 PolarHBondContact O-N 3.09Å; V161-Y164 PolarHBondContact O-N 3.27Å; Y162-Y164 VanDerWaalsContact C-N 3.29Å; Y162-Y164 PolarHBondContact O-N 3.46Å; Y164-V166 VanDerWaalsContact C-N 3.32Å; Y164-V166 PolarHBondContact O-N 2.74Å; Y164-L167 PolarHBondContact O-N 2.87Å; Y164-T168 WeakPolarHBondContact CD1-OG1 3.42Å; Y164-T168 WeakPolarHBondContact CE1-OG1 3.18Å; Y164-T168 WeakPolarHBondContact O-CB 3.46Å; Y164-T168 PolarHBondContact O-N 3.22Å; Y164-T168 PolarHBondContact O-OG1 3.22Å
165	T	73.2	Confident	72.7	Confident	68 Å²	68	68.2 Å²	68.2	42%	0.417	33%	0.332	S	S	.	.	H	α-helix	trans	-61.5	-44.3	177	-57.8	0	0	0	0	110.1	V161 Y162 T168 I169	V161-T165 WeakPolarHBondContact O-CB 3.35Å; V161-T165 PolarHBondContact O-N 3.47Å; V161-T165 PolarHBondContact O-OG1 2.91Å; Y162-T165 PolarHBondContact O-N 3.44Å; T165-T168 PolarHBondContact O-N 2.84Å; T165-I169 HydrophobicContact CG2-CD1 4.11Å; T165-I169 VanDerWaalsContact O-CG1 3.31Å; T165-I169 WeakPolarHBondContact O-CG1 3.45Å; T165-I169 PolarHBondContact O-N 2.94Å
166	V	78.2	Confident	73.5	Confident	80 Å²	80	62.8 Å²	62.8	49%	0.485	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-47.3	175.3	172.9	0	0	0	0	111.1	Y162 L163 Y164 T168 I169 I170	Y162-V166 WeakPolarHBondContact O-CG2 3.47Å; Y162-V166 PolarHBondContact O-N 3Å; L163-V166 PolarHBondContact O-N 2.95Å; Y164-V166 VanDerWaalsContact C-N 3.32Å; Y164-V166 PolarHBondContact O-N 2.74Å; V166-T168 VanDerWaalsContact C-N 3.28Å; V166-T168 PolarHBondContact O-N 3.41Å; V166-I169 PolarHBondContact O-N 2.91Å; V166-I170 HydrophobicContact CG1-CD1 3.92Å; V166-I170 WeakPolarHBondContact O-CG1 3.47Å; V166-I170 PolarHBondContact O-N 3.18Å
167	L	77.6	Confident	74.3	Confident	27 Å²	27	64.2 Å²	64.2	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-37.9	177	-70.8	173.1	0	0	0	112.6	W49 M53 L56 L163 Y164 I170 T171	W49-L167 HydrophobicContact CH2-CD2 4.07Å; M53-L167 HydrophobicContact SD-CD2 4.27Å; L56-L167 HydrophobicContact CD1-CD1 4.45Å; L56-L167 HydrophobicContact CD1-CD2 4.24Å; L163-L167 HydrophobicContact CG-CD1 4.43Å; L163-L167 WeakPolarHBondContact O-CG 3.42Å; L163-L167 PolarHBondContact O-N 2.98Å; Y164-L167 PolarHBondContact O-N 2.87Å; L167-I170 PolarHBondContact O-N 3.27Å; L167-T171 WeakPolarHBondContact O-CB 3.18Å; L167-T171 PolarHBondContact O-N 3.44Å; L167-T171 PolarHBondContact O-OG1 2.84Å
168	T	75.3	Confident	74.8	Confident	31 Å²	31	58 Å²	58	19%	0.19	29%	0.287	C	S	.	.	H	α-helix	trans	-66.4	-45.7	177.2	-56.2	0	0	0	0	110.9	Y164 T165 V166 I170 T171 I172	Y164-T168 WeakPolarHBondContact CD1-OG1 3.42Å; Y164-T168 WeakPolarHBondContact CE1-OG1 3.18Å; Y164-T168 WeakPolarHBondContact O-CB 3.46Å; Y164-T168 PolarHBondContact O-N 3.22Å; Y164-T168 PolarHBondContact O-OG1 3.22Å; T165-T168 PolarHBondContact O-N 2.84Å; V166-T168 VanDerWaalsContact C-N 3.28Å; V166-T168 PolarHBondContact O-N 3.41Å; T168-I170 VanDerWaalsContact C-N 3.33Å; T168-I170 PolarHBondContact O-N 3.28Å; T168-T171 WeakPolarHBondContact O-CB 3.41Å; T168-T171 PolarHBondContact O-N 3.48Å; T168-I172 HydrophobicContact CG2-CD1 4.16Å; T168-I172 WeakPolarHBondContact O-CG1 3.43Å; T168-I172 PolarHBondContact O-N 3.44Å
169	I	77.4	Confident	75.1	Confident	92 Å²	92	58.9 Å²	58.9	47%	0.472	30%	0.297	S	S	.	.	H	α-helix	trans	-58.8	-45.8	176.4	-69	165.8	0	0	0	110.6	T165 V166 T171 I172 I173	T165-I169 HydrophobicContact CG2-CD1 4.11Å; T165-I169 VanDerWaalsContact O-CG1 3.31Å; T165-I169 WeakPolarHBondContact O-CG1 3.45Å; T165-I169 PolarHBondContact O-N 2.94Å; V166-I169 PolarHBondContact O-N 2.91Å; I169-T171 VanDerWaalsContact C-N 3.32Å; I169-T171 PolarHBondContact O-N 3.47Å; I169-I172 WeakPolarHBondContact O-CB 3.45Å; I169-I172 PolarHBondContact O-N 2.84Å; I169-I173 HydrophobicContact CG2-CD1 4.39Å; I169-I173 WeakPolarHBondContact O-CG1 3.49Å; I169-I173 PolarHBondContact O-N 3.26Å; I169-I173 VanDerWaalsContact O-N 3.08Å
170	I	80	Confident	75.2	Confident	52 Å²	52	58.5 Å²	58.5	27%	0.267	30%	0.299	S	S	.	.	H	α-helix	trans	-63.4	-41.7	178.1	-60.2	164.3	0	0	0	110.5	W49 V166 L167 T168 I172 I173 F174	W49-I170 HydrophobicContact CD2-CG2 4.12Å; W49-I170 HydrophobicContact CE3-CG2 4.09Å; W49-I170 HydrophobicContact CH2-CB 3.71Å; W49-I170 HydrophobicContact CH2-CD1 3.87Å; W49-I170 HydrophobicContact CH2-CG1 4.4Å; W49-I170 HydrophobicContact CH2-CG2 3.28Å; W49-I170 HydrophobicContact CZ2-CB 3.59Å; W49-I170 HydrophobicContact CZ2-CG2 3.28Å; W49-I170 HydrophobicContact CZ3-CG2 3.69Å; V166-I170 HydrophobicContact CG1-CD1 3.92Å; V166-I170 WeakPolarHBondContact O-CG1 3.47Å; V166-I170 PolarHBondContact O-N 3.18Å; L167-I170 PolarHBondContact O-N 3.27Å; T168-I170 VanDerWaalsContact C-N 3.33Å; T168-I170 PolarHBondContact O-N 3.28Å; I170-I172 VanDerWaalsContact C-N 3.32Å; I170-I172 PolarHBondContact O-N 3.28Å; I170-I173 WeakPolarHBondContact O-CB 3.29Å; I170-I173 PolarHBondContact O-N 3.35Å; I170-I173 VanDerWaalsContact O-N 3.11Å; I170-F174 HydrophobicContact CG2-CD2 3.82Å; I170-F174 HydrophobicContact CG2-CE2 3.6Å; I170-F174 VanDerWaalsContact O-CD2 3.27Å; I170-F174 WeakPolarHBondContact O-CD2 3.37Å; I170-F174 PolarHBondContact O-N 3.25Å; I170-F174 VanDerWaalsContact O-N 3.12Å
171	T	78.2	Confident	75.1	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-39.9	176.1	-62.4	0	0	0	0	112.1	W49 L167 T168 I169 I173 F174 H175	W49-T171 PolarHBondContact NE1-OG1 2.79Å; L167-T171 WeakPolarHBondContact O-CB 3.18Å; L167-T171 PolarHBondContact O-N 3.44Å; L167-T171 PolarHBondContact O-OG1 2.84Å; T168-T171 WeakPolarHBondContact O-CB 3.41Å; T168-T171 PolarHBondContact O-N 3.48Å; I169-T171 VanDerWaalsContact C-N 3.32Å; I169-T171 PolarHBondContact O-N 3.47Å; T171-I173 VanDerWaalsContact C-N 3.34Å; T171-I173 PolarHBondContact O-N 2.8Å; T171-F174 PolarHBondContact O-N 2.96Å; T171-H175 PolarHBondContact O-CD2 2.84Å; T171-H175 PolarHBondContact O-N 3.21Å
172	I	77.6	Confident	75	Confident	93 Å²	93	61.9 Å²	61.9	48%	0.477	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-41.7	173.8	-68.5	164.7	0	0	0	111	T168 I169 I170 F174 H175 V176	T168-I172 HydrophobicContact CG2-CD1 4.16Å; T168-I172 WeakPolarHBondContact O-CG1 3.43Å; T168-I172 PolarHBondContact O-N 3.44Å; I169-I172 WeakPolarHBondContact O-CB 3.45Å; I169-I172 PolarHBondContact O-N 2.84Å; I170-I172 VanDerWaalsContact C-N 3.32Å; I170-I172 PolarHBondContact O-N 3.28Å; I172-F174 VanDerWaalsContact C-N 3.3Å; I172-F174 PolarHBondContact O-N 3.49Å; I172-H175 WeakPolarHBondContact O-CB 3.41Å; I172-H175 PolarHBondContact O-N 2.98Å; I172-V176 HydrophobicContact CG2-CG2 4.38Å; I172-V176 WeakPolarHBondContact O-CG2 3.04Å; I172-V176 PolarHBondContact O-N 3.31Å
173	I	80	Confident	74.3	Confident	89 Å²	89	58.7 Å²	58.7	46%	0.456	31%	0.309	S	S	.	.	H	α-helix	trans	-58.7	-44.4	176.7	-66.8	167.1	0	0	0	110.5	I169 I170 T171 V176 K177	I169-I173 HydrophobicContact CG2-CD1 4.39Å; I169-I173 WeakPolarHBondContact O-CG1 3.49Å; I169-I173 PolarHBondContact O-N 3.26Å; I169-I173 VanDerWaalsContact O-N 3.08Å; I170-I173 WeakPolarHBondContact O-CB 3.29Å; I170-I173 PolarHBondContact O-N 3.35Å; I170-I173 VanDerWaalsContact O-N 3.11Å; T171-I173 VanDerWaalsContact C-N 3.34Å; T171-I173 PolarHBondContact O-N 2.8Å; I173-V176 PolarHBondContact O-N 3.27Å; I173-K177 WeakPolarHBondContact O-CG 3.46Å; I173-K177 PolarHBondContact O-N 3.45Å
174	F	78.9	Confident	73.7	Confident	21 Å²	21	60.7 Å²	60.7	9%	0.092	32%	0.315	C	S	.	.	H	α-helix	trans	-68.2	-34.5	177	-77.4	-71.9	0	0	0	113.4	I46 W49 Q137 I170 T171 I172 K177 L178	I46-F174 HydrophobicContact CB-CD1 4.4Å; I46-F174 HydrophobicContact CG1-CD1 3.76Å; I46-F174 HydrophobicContact CG1-CE1 4.35Å; W49-F174 HydrophobicContact CB-CD1 4.32Å; W49-F174 HydrophobicContact CB-CD2 3.98Å; W49-F174 HydrophobicContact CB-CE1 4.08Å; W49-F174 HydrophobicContact CB-CE2 3.74Å; W49-F174 HydrophobicContact CB-CG 4.26Å; W49-F174 HydrophobicContact CB-CZ 3.78Å; W49-F174 AromaticContact CD1-CD2 3.31Å; W49-F174 AromaticContact CD1-CE2 3.83Å; W49-F174 AromaticContact CD1-CG 3.76Å; W49-F174 AromaticContact CD2-CD2 3.58Å; W49-F174 HydrophobicContact CD2-CD2 3.58Å; W49-F174 AromaticContact CD2-CE2 3.31Å; W49-F174 HydrophobicContact CD2-CE2 3.31Å; W49-F174 HydrophobicContact CD2-CZ 4.16Å; W49-F174 AromaticContact CE2-CD2 3.76Å; W49-F174 AromaticContact CE2-CE2 3.89Å; W49-F174 HydrophobicContact CE3-CD2 4.38Å; W49-F174 AromaticContact CE3-CE2 3.68Å; W49-F174 HydrophobicContact CE3-CE2 3.68Å; W49-F174 HydrophobicContact CE3-CZ 4.35Å; W49-F174 HydrophobicContact CG-CD1 4.46Å; W49-F174 AromaticContact CG-CD2 3.31Å; W49-F174 HydrophobicContact CG-CD2 3.31Å; W49-F174 HydrophobicContact CG-CE1 4.44Å; W49-F174 AromaticContact CG-CE2 3.31Å; W49-F174 HydrophobicContact CG-CE2 3.31Å; W49-F174 AromaticContact CG-CG 3.93Å; W49-F174 HydrophobicContact CG-CG 3.93Å; W49-F174 AromaticContact CG-CZ 3.9Å; W49-F174 HydrophobicContact CG-CZ 3.9Å; W49-F174 HydrophobicContact CZ3-CE2 4.49Å; W49-F174 AromaticContact NE1-CD2 3.56Å; Q137-F174 PolarHBondContact NE2-O 3.28Å; I170-F174 HydrophobicContact CG2-CD2 3.82Å; I170-F174 HydrophobicContact CG2-CE2 3.6Å; I170-F174 VanDerWaalsContact O-CD2 3.27Å; I170-F174 WeakPolarHBondContact O-CD2 3.37Å; I170-F174 PolarHBondContact O-N 3.25Å; I170-F174 VanDerWaalsContact O-N 3.12Å; T171-F174 PolarHBondContact O-N 2.96Å; I172-F174 VanDerWaalsContact C-N 3.3Å; I172-F174 PolarHBondContact O-N 3.49Å; F174-K177 PolarHBondContact O-N 2.9Å; F174-L178 WeakPolarHBondContact O-CB 3.46Å; F174-L178 PolarHBondContact O-N 2.99Å
175	H	77.2	Confident	73	Confident	44 Å²	44	60.8 Å²	60.8	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-46.6	170.6	-97.5	-81.3	0	0	0	112.1	Q137 S141 T171 I172 L178 S179	Q137-H175 VanDerWaalsContact CB-CE1 3.49Å; Q137-H175 WeakPolarHBondContact CB-CE1 3.28Å; Q137-H175 PolarHBondContact O-CE1 3.34Å; Q137-H175 PolarHBondContact O-NE2 2.94Å; S141-H175 PolarHBondContact OG-CE1 3.38Å; S141-H175 PolarHBondContact OG-NE2 2.86Å; T171-H175 PolarHBondContact O-CD2 2.84Å; T171-H175 PolarHBondContact O-N 3.21Å; I172-H175 WeakPolarHBondContact O-CB 3.41Å; I172-H175 PolarHBondContact O-N 2.98Å; H175-L178 PolarHBondContact O-N 3.3Å; H175-S179 WeakPolarHBondContact O-CB 3.34Å; H175-S179 PolarHBondContact O-N 3.33Å; H175-S179 PolarHBondContact O-OG 3.09Å
176	V	76.3	Confident	72.1	Confident	72 Å²	72	65.4 Å²	65.4	44%	0.436	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-41.4	178.3	172.6	0	0	0	0	110.6	I172 I173 S179 K180	I172-V176 HydrophobicContact CG2-CG2 4.38Å; I172-V176 WeakPolarHBondContact O-CG2 3.04Å; I172-V176 PolarHBondContact O-N 3.31Å; I173-V176 PolarHBondContact O-N 3.27Å; V176-S179 PolarHBondContact O-N 2.93Å; V176-K180 HydrophobicContact CG1-CD 4.4Å; V176-K180 WeakPolarHBondContact O-CG 3.16Å; V176-K180 PolarHBondContact O-N 2.86Å
177	K	76.2	Confident	70.9	Confident	78 Å²	78	66.3 Å²	66.3	34%	0.339	33%	0.332	S	S	.	.	H	α-helix	trans	-59.3	-48.2	174	-78.3	-171.9	171.8	-160.9	0	111.5	D42 I46 I173 F174 S179 K180 I181	D42-K177 IonicContact OD1-NZ 3.56Å; I46-K177 HydrophobicContact CD1-CB 4.49Å; I173-K177 WeakPolarHBondContact O-CG 3.46Å; I173-K177 PolarHBondContact O-N 3.45Å; F174-K177 PolarHBondContact O-N 2.9Å; K177-S179 VanDerWaalsContact C-N 3.34Å; K177-S179 PolarHBondContact O-N 2.94Å; K177-K180 PolarHBondContact O-N 3.29Å; K177-I181 VanDerWaalsContact O-CG1 3.29Å; K177-I181 WeakPolarHBondContact O-CG1 2.91Å; K177-I181 PolarHBondContact O-N 3.18Å
178	L	73.7	Confident	69.8	Low	2 Å²	2	67.9 Å²	67.9	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-64.1	-39.4	178.6	-169.2	67.5	0	0	0	112.1	I46 M130 I133 H134 F174 H175 K180 I181 Q182	I46-L178 HydrophobicContact CD1-CB 4.43Å; I46-L178 HydrophobicContact CD1-CD1 4.18Å; M130-L178 HydrophobicContact CE-CD1 3.74Å; I133-L178 HydrophobicContact CG2-CD1 4.3Å; I133-L178 HydrophobicContact CG2-CD2 3.76Å; H134-L178 WeakPolarHBondContact CE1-CD2 3.21Å; H134-L178 WeakPolarHBondContact ND1-CD2 3.38Å; F174-L178 WeakPolarHBondContact O-CB 3.46Å; F174-L178 PolarHBondContact O-N 2.99Å; H175-L178 PolarHBondContact O-N 3.3Å; L178-K180 PolarHBondContact O-N 3.47Å; L178-I181 WeakPolarHBondContact O-CB 3.35Å; L178-I181 PolarHBondContact O-N 3.3Å; L178-Q182 PolarHBondContact O-N 3.27Å
179	S	73.8	Confident	68.9	Low	59 Å²	59	68.8 Å²	68.8	41%	0.413	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-40.5	175.8	-59.1	0	0	0	0	112	H175 V176 K177 I181 Q182 V183	H175-S179 WeakPolarHBondContact O-CB 3.34Å; H175-S179 PolarHBondContact O-N 3.33Å; H175-S179 PolarHBondContact O-OG 3.09Å; V176-S179 PolarHBondContact O-N 2.93Å; K177-S179 VanDerWaalsContact C-N 3.34Å; K177-S179 PolarHBondContact O-N 2.94Å; S179-I181 VanDerWaalsContact C-N 3.34Å; S179-Q182 WeakPolarHBondContact O-CB 3.24Å; S179-Q182 PolarHBondContact O-N 2.59Å; S179-V183 WeakPolarHBondContact O-CG2 3.25Å; S179-V183 PolarHBondContact O-N 3.33Å
180	K	70	Confident	67.8	Low	135 Å²	135	67.6 Å²	67.6	59%	0.587	34%	0.344	S	S	*	.	H	α-helix	trans	-64.1	-40.1	173.7	-75.1	-179.8	-176.6	-175.8	0	111.9	V176 K177 L178 Q182 V183 K184	V176-K180 HydrophobicContact CG1-CD 4.4Å; V176-K180 WeakPolarHBondContact O-CG 3.16Å; V176-K180 PolarHBondContact O-N 2.86Å; K177-K180 PolarHBondContact O-N 3.29Å; L178-K180 PolarHBondContact O-N 3.47Å; K180-Q182 VanDerWaalsContact C-N 3.33Å; K180-V183 PolarHBondContact O-N 3.39Å; K180-K184 WeakPolarHBondContact O-CG 3.22Å; K180-K184 PolarHBondContact O-N 2.84Å
181	I	66.8	Low	66.9	Low	12 Å²	12	71.2 Å²	71.2	6%	0.062	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-44.8	174.6	-72.5	168.1	0	0	0	110.2	L38 D42 I46 M130 K177 L178 S179 K184 G185	L38-I181 HydrophobicContact CD2-CG2 3.28Å; L38-I181 HydrophobicContact CG-CG2 3.69Å; D42-I181 HydrophobicContact CB-CD1 4.07Å; I46-I181 HydrophobicContact CD1-CD1 3.55Å; M130-I181 HydrophobicContact CE-CG2 4.4Å; K177-I181 VanDerWaalsContact O-CG1 3.29Å; K177-I181 WeakPolarHBondContact O-CG1 2.91Å; K177-I181 PolarHBondContact O-N 3.18Å; L178-I181 WeakPolarHBondContact O-CB 3.35Å; L178-I181 PolarHBondContact O-N 3.3Å; S179-I181 VanDerWaalsContact C-N 3.34Å; I181-K184 PolarHBondContact O-N 3.4Å; I181-G185 PolarHBondContact O-N 2.76Å
182	Q	66	Low	66.3	Low	90 Å²	90	74.7 Å²	74.7	42%	0.421	37%	0.373	S	S	.	.	H	α-helix	trans	-58.2	-55.1	174	-179	179.9	-10.3	0	0	110.8	L178 S179 K180 K184 G185 W186	L178-Q182 PolarHBondContact O-N 3.27Å; S179-Q182 WeakPolarHBondContact O-CB 3.24Å; S179-Q182 PolarHBondContact O-N 2.59Å; K180-Q182 VanDerWaalsContact C-N 3.33Å; Q182-K184 VanDerWaalsContact C-N 3.3Å; Q182-K184 PolarHBondContact O-N 3.05Å; Q182-G185 CarbonylContact O-C 3.47Å; Q182-G185 WeakPolarHBondContact O-CA 3.39Å; Q182-G185 PolarHBondContact O-N 3.3Å; Q182-W186 PolarHBondContact O-N 2.88Å
183	V	58.7	Low	65.7	Low	85 Å²	85	77 Å²	77	52%	0.515	38%	0.377	S	S	.	.	H	α-helix	trans	-56.2	-43.8	-178.3	172.3	0	0	0	0	111.6	S179 K180 G185 W186 I187	S179-V183 WeakPolarHBondContact O-CG2 3.25Å; S179-V183 PolarHBondContact O-N 3.33Å; K180-V183 PolarHBondContact O-N 3.39Å; V183-G185 VanDerWaalsContact C-N 3.33Å; V183-G185 PolarHBondContact O-N 2.82Å; V183-W186 PolarHBondContact O-N 2.67Å; V183-I187 HydrophobicContact CG1-CD1 3.61Å; V183-I187 HydrophobicContact CG1-CG1 4.21Å; V183-I187 WeakPolarHBondContact O-CB 3.12Å; V183-I187 WeakPolarHBondContact O-CD1 3.48Å; V183-I187 WeakPolarHBondContact O-CG1 3.13Å; V183-I187 PolarHBondContact O-N 3.35Å
184	K	61	Low	65.3	Low	123 Å²	123	78.6 Å²	78.6	54%	0.535	38%	0.381	S	S	.	.	H	α-helix	trans	-59.3	-43.1	173.2	-75	179.2	175.1	-175	0	112.1	D39 K180 I181 Q182	D39-K184 IonicContact OD2-NZ 3.26Å; D39-K184 PolarHBondContact OD2-NZ 2.77Å; K180-K184 WeakPolarHBondContact O-CG 3.22Å; K180-K184 PolarHBondContact O-N 2.84Å; I181-K184 PolarHBondContact O-N 3.4Å; Q182-K184 VanDerWaalsContact C-N 3.3Å; Q182-K184 PolarHBondContact O-N 3.05Å
185	G	58	Low	64.6	Low	20 Å²	20	82.5 Å²	82.5	21%	0.206	40%	0.402	C	S	.	.	H	α-helix	trans	-63.8	-33.9	176.9	0	0	0	0	0	114.2	I181 Q182 V183 P189	I181-G185 PolarHBondContact O-N 2.76Å; Q182-G185 CarbonylContact O-C 3.47Å; Q182-G185 WeakPolarHBondContact O-CA 3.39Å; Q182-G185 PolarHBondContact O-N 3.3Å; V183-G185 VanDerWaalsContact C-N 3.33Å; V183-G185 PolarHBondContact O-N 2.82Å; G185-P189 WeakPolarHBondContact O-CD 3.42Å; G185-P189 WeakPolarHBondContact O-CG 2.87Å
186	W	52.9	Low	64.1	Low	165 Å²	165	84.5 Å²	84.5	63%	0.625	42%	0.418	S	S	*	.	H	α-helix	trans	-84.9	-30.5	178	-77.2	83.7	0	0	0	113.6	Q182 V183 L188 P189 V190	Q182-W186 PolarHBondContact O-N 2.88Å; V183-W186 PolarHBondContact O-N 2.67Å; W186-L188 PolarHBondContact O-N 3.41Å; W186-P189 WeakPolarHBondContact O-CD 3.32Å; W186-P189 VanDerWaalsContact O-CG 3.24Å; W186-P189 WeakPolarHBondContact O-CG 3.42Å; W186-V190 WeakPolarHBondContact O-CB 3.49Å; W186-V190 WeakPolarHBondContact O-CG2 3.22Å; W186-V190 PolarHBondContact O-N 2.7Å
187	I	53.6	Low	63.5	Low	99 Å²	99	86.6 Å²	86.6	51%	0.508	42%	0.421	S	S	.	.	H	α-helix	trans	-58.9	-38.8	178.5	-76.5	162.2	0	0	0	111	V183 K191	V183-I187 HydrophobicContact CG1-CD1 3.61Å; V183-I187 HydrophobicContact CG1-CG1 4.21Å; V183-I187 WeakPolarHBondContact O-CB 3.12Å; V183-I187 WeakPolarHBondContact O-CD1 3.48Å; V183-I187 WeakPolarHBondContact O-CG1 3.13Å; V183-I187 PolarHBondContact O-N 3.35Å; I187-K191 WeakPolarHBondContact O-CB 3.21Å; I187-K191 PolarHBondContact O-N 3.13Å
188	L	54.5	Low	62.6	Low	61 Å²	61	87.7 Å²	87.7	32%	0.319	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-54.5	179.1	-171	71.6	0	0	0	113.3	N34 V36 W186 V190 K191 Q192	N34-L188 HydrophobicContact CB-CD2 4.44Å; N34-L188 WeakPolarHBondContact OD1-CD2 3.36Å; V36-L188 HydrophobicContact CG2-CB 4.06Å; V36-L188 HydrophobicContact CG2-CD2 3.58Å; V36-L188 HydrophobicContact CG2-CG 4.46Å; W186-L188 PolarHBondContact O-N 3.41Å; L188-V190 VanDerWaalsContact C-N 3.34Å; L188-V190 PolarHBondContact O-N 2.85Å; L188-K191 PolarHBondContact O-N 2.66Å; L188-Q192 WeakPolarHBondContact O-CB 3.23Å; L188-Q192 WeakPolarHBondContact O-CG 3.46Å; L188-Q192 PolarHBondContact O-N 3.12Å
189	P	55.4	Low	61.8	Low	50 Å²	50	90.7 Å²	90.7	33%	0.325	45%	0.451	S	S	.	.	H	α-helix	trans	-66.2	-34	177.7	23.3	-32.4	0	0	0	112.3	G185 W186 Q192 Y193	G185-P189 WeakPolarHBondContact O-CD 3.42Å; G185-P189 WeakPolarHBondContact O-CG 2.87Å; W186-P189 WeakPolarHBondContact O-CD 3.32Å; W186-P189 VanDerWaalsContact O-CG 3.24Å; W186-P189 WeakPolarHBondContact O-CG 3.42Å; P189-Q192 PolarHBondContact O-N 2.74Å; P189-Y193 VanDerWaalsContact O-CB 3.23Å; P189-Y193 WeakPolarHBondContact O-CB 3.21Å; P189-Y193 PolarHBondContact O-N 3.31Å
190	V	54.9	Low	60.7	Low	66 Å²	66	91 Å²	91	40%	0.4	45%	0.45	S	S	.	.	H	α-helix	trans	-64.1	-47.1	173.5	171.5	0	0	0	0	110.5	W186 L188 Q192 Y193 F194	W186-V190 WeakPolarHBondContact O-CB 3.49Å; W186-V190 WeakPolarHBondContact O-CG2 3.22Å; W186-V190 PolarHBondContact O-N 2.7Å; L188-V190 VanDerWaalsContact C-N 3.34Å; L188-V190 PolarHBondContact O-N 2.85Å; V190-Q192 VanDerWaalsContact C-N 3.34Å; V190-Q192 PolarHBondContact O-N 2.54Å; V190-Y193 PolarHBondContact O-N 3.48Å; V190-F194 HydrophobicContact CG1-CD2 3.57Å; V190-F194 HydrophobicContact CG1-CE2 3.52Å; V190-F194 WeakPolarHBondContact O-CD2 3.28Å; V190-F194 PolarHBondContact O-N 3.47Å
191	K	61.7	Low	59.6	Low	129 Å²	129	91.1 Å²	91.1	56%	0.561	45%	0.453	S	S	*	.	H	α-helix	trans	-60.2	-43.7	175.6	-175.2	-179.2	178.8	-177.7	0	111.3	I187 L188 L195	I187-K191 WeakPolarHBondContact O-CB 3.21Å; I187-K191 PolarHBondContact O-N 3.13Å; L188-K191 PolarHBondContact O-N 2.66Å; K191-L195 HydrophobicContact CG-CD1 3.92Å; K191-L195 HydrophobicContact CG-CG 4.4Å; K191-L195 VanDerWaalsContact O-CB 3.28Å; K191-L195 WeakPolarHBondContact O-CB 3.37Å; K191-L195 WeakPolarHBondContact O-CG 3.45Å; K191-L195 PolarHBondContact O-N 3.47Å
192	Q	65.2	Low	58.7	Low	75 Å²	75	96.9 Å²	96.9	35%	0.35	48%	0.484	S	S	.	.	H	α-helix	trans	-65.2	-42.1	176	-75.5	175.2	-7.3	0	0	112.1	N34 L188 P189 V190 L195 T196	N34-Q192 PolarHBondContact ND2-OE1 3.1Å; N34-Q192 PolarHBondContact OD1-NE2 3.27Å; N34-Q192 VanDerWaalsContact OD1-NE2 3.12Å; L188-Q192 WeakPolarHBondContact O-CB 3.23Å; L188-Q192 WeakPolarHBondContact O-CG 3.46Å; L188-Q192 PolarHBondContact O-N 3.12Å; P189-Q192 PolarHBondContact O-N 2.74Å; V190-Q192 VanDerWaalsContact C-N 3.34Å; V190-Q192 PolarHBondContact O-N 2.54Å; Q192-L195 PolarHBondContact O-N 3.43Å; Q192-T196 VanDerWaalsContact O-CB 3.24Å; Q192-T196 WeakPolarHBondContact O-CB 3.24Å; Q192-T196 PolarHBondContact O-N 3.18Å; Q192-T196 PolarHBondContact O-OG1 3.46Å
193	Y	65.4	Low	57.7	Low	143 Å²	143	97.5 Å²	97.5	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-60	-49.3	175.8	179.1	-96.3	0	0	0	111.2	P189 V190 T196 K197	P189-Y193 VanDerWaalsContact O-CB 3.23Å; P189-Y193 WeakPolarHBondContact O-CB 3.21Å; P189-Y193 PolarHBondContact O-N 3.31Å; V190-Y193 PolarHBondContact O-N 3.48Å; Y193-T196 PolarHBondContact O-N 3.02Å; Y193-K197 HydrophobicContact CD1-CG 4.42Å; Y193-K197 HydrophobicContact CD2-CG 4.47Å; Y193-K197 HydrophobicContact CE1-CG 4.03Å; Y193-K197 HydrophobicContact CE2-CG 4.07Å; Y193-K197 VanDerWaalsContact O-CB 3.32Å; Y193-K197 WeakPolarHBondContact O-CB 3.36Å; Y193-K197 WeakPolarHBondContact O-CG 3.33Å; Y193-K197 PolarHBondContact O-N 2.99Å
194	F	70.2	Confident	56.9	Low	122 Å²	122	102.9 Å²	102.9	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-62.5	-48	175.4	-80.9	-68	0	0	0	111.5	V190 T196 K197 L198	V190-F194 HydrophobicContact CG1-CD2 3.57Å; V190-F194 HydrophobicContact CG1-CE2 3.52Å; V190-F194 WeakPolarHBondContact O-CD2 3.28Å; V190-F194 PolarHBondContact O-N 3.47Å; F194-T196 VanDerWaalsContact C-N 3.29Å; F194-T196 PolarHBondContact O-N 3.48Å; F194-K197 PolarHBondContact O-N 3.14Å; F194-L198 HydrophobicContact CB-CD1 4.24Å; F194-L198 VanDerWaalsContact O-CB 3.22Å; F194-L198 WeakPolarHBondContact O-CB 3.5Å; F194-L198 WeakPolarHBondContact O-CD1 2.91Å; F194-L198 PolarHBondContact O-N 3.08Å
195	L	66.1	Low	56	Low	103 Å²	103	107.6 Å²	107.6	54%	0.539	52%	0.523	S	S	.	.	H	α-helix	trans	-59.7	-38.6	177.8	-76.2	171.8	0	0	0	112.6	K191 Q192 S199	K191-L195 HydrophobicContact CG-CD1 3.92Å; K191-L195 HydrophobicContact CG-CG 4.4Å; K191-L195 VanDerWaalsContact O-CB 3.28Å; K191-L195 WeakPolarHBondContact O-CB 3.37Å; K191-L195 WeakPolarHBondContact O-CG 3.45Å; K191-L195 PolarHBondContact O-N 3.47Å; Q192-L195 PolarHBondContact O-N 3.43Å; L195-S199 WeakPolarHBondContact O-CB 3.44Å; L195-S199 PolarHBondContact O-N 3.1Å; L195-S199 PolarHBondContact O-OG 3.3Å
196	T	65.9	Low	55.4	Low	85 Å²	85	111.4 Å²	111.4	52%	0.521	55%	0.546	S	S	.	.	H	α-helix	trans	-73.7	-40	-179.8	-53.4	0	0	0	0	111.1	Q192 Y193 F194 S199 T200	Q192-T196 VanDerWaalsContact O-CB 3.24Å; Q192-T196 WeakPolarHBondContact O-CB 3.24Å; Q192-T196 PolarHBondContact O-N 3.18Å; Q192-T196 PolarHBondContact O-OG1 3.46Å; Y193-T196 PolarHBondContact O-N 3.02Å; F194-T196 VanDerWaalsContact C-N 3.29Å; F194-T196 PolarHBondContact O-N 3.48Å; T196-S199 PolarHBondContact O-OG 3.35Å; T196-S199 VanDerWaalsContact O-OG 3.14Å; T196-T200 PolarHBondContact O-N 3.33Å; T196-T200 PolarHBondContact O-OG1 2.92Å
197	K	64.6	Low	55	Low	117 Å²	117	108.1 Å²	108.1	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-70.6	-40.4	175.5	-77.4	-71	-173.6	179.3	0	112.5	Y193 F194 T200 Q201	Y193-K197 HydrophobicContact CD1-CG 4.42Å; Y193-K197 HydrophobicContact CD2-CG 4.47Å; Y193-K197 HydrophobicContact CE1-CG 4.03Å; Y193-K197 HydrophobicContact CE2-CG 4.07Å; Y193-K197 VanDerWaalsContact O-CB 3.32Å; Y193-K197 WeakPolarHBondContact O-CB 3.36Å; Y193-K197 WeakPolarHBondContact O-CG 3.33Å; Y193-K197 PolarHBondContact O-N 2.99Å; F194-K197 PolarHBondContact O-N 3.14Å; K197-T200 WeakPolarHBondContact CA-OG1 3.37Å; K197-T200 PolarHBondContact O-OG1 3.26Å; K197-T200 VanDerWaalsContact O-OG1 3.13Å; K197-Q201 PolarHBondContact O-N 3.12Å
198	L	56.7	Low	54.7	Low	101 Å²	101	110.2 Å²	110.2	53%	0.529	56%	0.561	S	S	.	*	H	α-helix	trans	-66.7	-39	172.8	-88	136	0	0	0	111.4	F194 Q201 N202	F194-L198 HydrophobicContact CB-CD1 4.24Å; F194-L198 VanDerWaalsContact O-CB 3.22Å; F194-L198 WeakPolarHBondContact O-CB 3.5Å; F194-L198 WeakPolarHBondContact O-CD1 2.91Å; F194-L198 PolarHBondContact O-N 3.08Å; L198-Q201 WeakPolarHBondContact O-CB 3.47Å; L198-Q201 PolarHBondContact O-N 3.09Å; L198-N202 PolarHBondContact O-N 3.02Å
199	S	56.9	Low	54.2	Low	64 Å²	64	115 Å²	115	45%	0.448	59%	0.586	S	S	.	*	H	α-helix	trans	-69.8	-36.5	177.1	80.5	0	0	0	0	112.7	L195 T196 Q201 N202 T203	L195-S199 WeakPolarHBondContact O-CB 3.44Å; L195-S199 PolarHBondContact O-N 3.1Å; L195-S199 PolarHBondContact O-OG 3.3Å; T196-S199 PolarHBondContact O-OG 3.35Å; T196-S199 VanDerWaalsContact O-OG 3.14Å; S199-Q201 VanDerWaalsContact C-N 3.3Å; S199-Q201 PolarHBondContact O-N 3.26Å; S199-N202 PolarHBondContact O-N 2.84Å; S199-T203 PolarHBondContact O-N 2.77Å; S199-T203 PolarHBondContact O-OG1 3.35Å
200	T	51.1	Low	53.5	Low	66 Å²	66	116.8 Å²	116.8	41%	0.405	61%	0.605	S	S	.	*	H	α-helix	trans	-67.2	-31.4	172.6	29.6	0	0	0	0	112.2	T196 K197 N202 T203	T196-T200 PolarHBondContact O-N 3.33Å; T196-T200 PolarHBondContact O-OG1 2.92Å; K197-T200 WeakPolarHBondContact CA-OG1 3.37Å; K197-T200 PolarHBondContact O-OG1 3.26Å; K197-T200 VanDerWaalsContact O-OG1 3.13Å; T200-N202 VanDerWaalsContact C-N 3.29Å; T200-N202 PolarHBondContact O-N 3.13Å; T200-T203 PolarHBondContact O-N 3.15Å; T200-T203 VanDerWaalsContact O-N 3.12Å
201	Q	47.2	Very low	52.7	Low	138 Å²	138	120 Å²	120	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-65.5	-32.4	171.9	-124.2	179.6	-6.7	0	0	112.5	K197 L198 S199 T203	K197-Q201 PolarHBondContact O-N 3.12Å; L198-Q201 WeakPolarHBondContact O-CB 3.47Å; L198-Q201 PolarHBondContact O-N 3.09Å; S199-Q201 VanDerWaalsContact C-N 3.3Å; S199-Q201 PolarHBondContact O-N 3.26Å; Q201-T203 VanDerWaalsContact C-N 3.27Å; Q201-T203 PolarHBondContact O-N 3.48Å
202	N	47.2	Very low	51.6	Low	132 Å²	132	126.8 Å²	126.8	71%	0.706	66%	0.655	S	S	*	*	H	α-helix	trans	-72.9	-16.5	172.5	-76.2	-4.6	0	0	0	113.6	L198 S199 T200	L198-N202 PolarHBondContact O-N 3.02Å; S199-N202 PolarHBondContact O-N 2.84Å; T200-N202 VanDerWaalsContact C-N 3.29Å; T200-N202 PolarHBondContact O-N 3.13Å
203	T	43.9	Very low	51	Low	104 Å²	104	129.4 Å²	129.4	64%	0.638	67%	0.67	S	S	*	*	H	α-helix	trans	-84.4	-18.6	178.4	-25.5	0	0	0	0	112.9	S199 T200 Q201	S199-T203 PolarHBondContact O-N 2.77Å; S199-T203 PolarHBondContact O-OG1 3.35Å; T200-T203 PolarHBondContact O-N 3.15Å; T200-T203 VanDerWaalsContact O-N 3.12Å; Q201-T203 VanDerWaalsContact C-N 3.27Å; Q201-T203 PolarHBondContact O-N 3.48Å
204	Y	42.4	Very low	50.2	Low	197 Å²	197	128.6 Å²	128.6	77%	0.773	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	0.9	-179.2	-89.6	-85.2	0	0	0	114.9
205	Y	42	Very low	49.1	Very low	222 Å²	222	129 Å²	129	87%	0.871	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	19.8	177.9	-106	-79.4	0	0	0	114.7
206	S	45.3	Very low	48.1	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	69%	0.692	S	S	*	*	S	Bend	trans	-133.6	46.5	176.5	-173.5	0	0	0	0	113.3
207	S	45	Very low	47	Very low	96 Å²	96	133.4 Å²	133.4	67%	0.671	70%	0.703	S	S	*	*	S	Bend	trans	-132.4	12.2	166.6	74.9	0	0	0	0	115.4
208	N	46.7	Very low	45.8	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	72%	0.716	S	S	*	*	S	Bend	trans	-122.4	8.8	174.1	-94.8	8.7	0	0	0	115.7
209	D	44.2	Very low	45	Very low	160 Å²	160	136.9 Å²	136.9	86%	0.856	73%	0.729	S	S	*	*	S	Bend	trans	-117.6	115.3	158.2	-74.6	-31.3	0	0	0	106.3
210	A	40.1	Very low	44.1	Very low	88 Å²	88	142.5 Å²	142.5	73%	0.727	75%	0.751	S	S	*	*			cis	-142.3	114.7	15.4	0	0	0	0	0	109.4	K212	A210-K212 VanDerWaalsContact C-N 3.3Å; A210-K212 PolarHBondContact O-N 3.04Å
211	T	39.8	Very low	43.5	Very low	133 Å²	133	148.8 Å²	148.8	82%	0.816	78%	0.78	S	S	*	*			trans	-72.6	94.1	145.3	12	0	0	0	0	106.3
212	K	38.7	Very low	43.2	Very low	272 Å²	272	149.8 Å²	149.8	100%	1.183	79%	0.792	S	S	*	*			trans	-163.6	0	156.5	-105.9	176	-165.9	-175.8	0	110	A210	A210-K212 VanDerWaalsContact C-N 3.3Å; A210-K212 PolarHBondContact O-N 3.04Å

Retrieved 212 of 212 residues in 64.2 ms (Link to these results)

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