A0A077Z8V2_TRITR Loading...

RNase H2-Ydr279 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z8V2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 246 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.7	Very low	38.5	Very low	222 Å²	222	157.8 Å²	157.8	100%	1.094	74%	0.744	S	S	*	*				0	-29.2	0	-80.3	-177.3	-176.9	0	0	114.9	Q3 F4	M1-Q3 VanDerWaalsContact C-N 3.31Å; M1-Q3 PolarHBondContact O-N 3.37Å; M1-F4 PolarHBondContact O-N 3.2Å
2	K	40.8	Very low	38.4	Very low	205 Å²	205	153.8 Å²	153.8	89%	0.891	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-26.5	-179.3	-70.4	-177.1	177.8	179.1	0	115.4
3	Q	43.3	Very low	38.2	Very low	185 Å²	185	152.5 Å²	152.5	86%	0.864	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-11.6	178.7	-66.8	-150.9	-1.4	0	0	115.3	M1	M1-Q3 VanDerWaalsContact C-N 3.31Å; M1-Q3 PolarHBondContact O-N 3.37Å
4	F	36.6	Very low	37.8	Very low	141 Å²	141	148.4 Å²	148.4	62%	0.618	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-86.6	-14.9	-179.7	-123.8	-92.3	0	0	0	113.4	M1 K6 R7	M1-F4 PolarHBondContact O-N 3.2Å; F4-K6 PolarHBondContact O-N 2.94Å; F4-R7 PolarHBondContact O-N 3.35Å
5	R	39.6	Very low	37.7	Very low	181 Å²	181	143.3 Å²	143.3	68%	0.683	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-68.8	-16.4	175	-82	-171.6	173.9	-171.9	-1.9	113.9
6	K	40.5	Very low	37.6	Very low	204 Å²	204	140.6 Å²	140.6	89%	0.887	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-80.8	-13.1	179.4	-115.9	-179.9	179.8	-177.8	0	114.2	F4	F4-K6 PolarHBondContact O-N 2.94Å
7	R	36.8	Very low	37.4	Very low	212 Å²	212	136.9 Å²	136.9	80%	0.8	69%	0.686	S	S	*	*	S	Bend	trans	-103.2	-4.3	-171.7	-147.9	170.5	176.4	179.3	-2	114	F4	F4-R7 PolarHBondContact O-N 3.35Å
8	W	38.6	Very low	37.1	Very low	159 Å²	159	135.7 Å²	135.7	60%	0.602	69%	0.687	S	S	*	*	S	Bend	trans	-108.8	111.9	168.3	-69.5	88.8	0	0	0	106.7	L10	W8-L10 VanDerWaalsContact C-N 3.33Å; W8-L10 PolarHBondContact O-N 2.78Å
9	G	31.9	Very low	37	Very low	73 Å²	73	137.1 Å²	137.1	75%	0.753	69%	0.688	S	S	*	*			trans	-55.5	81.6	-166.8	0	0	0	0	0	115.5	A11	G9-A11 PolarHBondContact O-N 3.36Å
10	L	35	Very low	37.1	Very low	93 Å²	93	140.5 Å²	140.5	49%	0.487	70%	0.702	S	S	.	*			trans	-80.3	79.3	154.6	-75.9	159.6	0	0	0	106.9	W8 N12 Q30	W8-L10 VanDerWaalsContact C-N 3.33Å; W8-L10 PolarHBondContact O-N 2.78Å; L10-N12 PolarHBondContact O-N 3.42Å; L10-N12 VanDerWaalsContact O-N 3.17Å; L10-Q30 HydrophobicContact CD2-CG 4.22Å
11	A	33.2	Very low	37.4	Very low	61 Å²	61	137 Å²	137	50%	0.504	70%	0.701	S	S	.	*			trans	-72.1	99.4	161	0	0	0	0	0	106.7	G9 E13	G9-A11 PolarHBondContact O-N 3.36Å; A11-E13 PolarHBondContact O-N 3.12Å; A11-E13 VanDerWaalsContact O-N 3.13Å
12	N	36.4	Very low	36.7	Very low	109 Å²	109	130.1 Å²	130.1	58%	0.583	69%	0.687	S	S	*	*			trans	-74.7	94.4	165.3	-73.9	-17.7	0	0	0	106.9	L10 C14	L10-N12 PolarHBondContact O-N 3.42Å; L10-N12 VanDerWaalsContact O-N 3.17Å; N12-C14 PolarHBondContact O-N 3.09Å
13	E	35.8	Very low	36.4	Very low	138 Å²	138	127.1 Å²	127.1	65%	0.645	68%	0.68	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.7	107.4	160.1	-83.2	-174.7	161.2	0	0	107.7	A11 V15	A11-E13 PolarHBondContact O-N 3.12Å; A11-E13 VanDerWaalsContact O-N 3.13Å; E13-V15 PolarHBondContact O-N 3.34Å
14	C	32.9	Very low	36	Very low	94 Å²	94	126.6 Å²	126.6	64%	0.635	68%	0.678	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.4	108.4	165.1	-69.6	0	0	0	0	107.7	N12	N12-C14 PolarHBondContact O-N 3.09Å
15	V	36.3	Very low	36.1	Very low	72 Å²	72	123.4 Å²	123.4	44%	0.436	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.8	110.3	169	-177.1	0	0	0	0	107.3	E13 V17	E13-V15 PolarHBondContact O-N 3.34Å; V15-V17 HydrophobicContact CG1-CG2 4.17Å; V15-V17 PolarHBondContact O-N 3.37Å
16	S	35.5	Very low	35.9	Very low	101 Å²	101	119.4 Å²	119.4	71%	0.706	67%	0.673	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.4	113.7	168.2	43.4	0	0	0	0	109
17	V	34.1	Very low	35.8	Very low	77 Å²	77	111.6 Å²	111.6	47%	0.467	64%	0.642	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.7	116.8	170.7	-177.6	0	0	0	0	107.6	V15	V15-V17 HydrophobicContact CG1-CG2 4.17Å; V15-V17 PolarHBondContact O-N 3.37Å
18	T	32.9	Very low	35.8	Very low	116 Å²	116	103.7 Å²	103.7	71%	0.712	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.2	116.6	171.1	30.6	0	0	0	0	109.3
19	F	35.6	Very low	35.7	Very low	162 Å²	162	98 Å²	98	71%	0.711	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-82.5	139.1	165.4	-107.7	-97.3	0	0	0	109.5	G21 G22	F19-G21 PolarHBondContact O-N 3.39Å; F19-G22 PolarHBondContact O-N 2.97Å
20	E	39.2	Very low	36.3	Very low	205 Å²	205	96.9 Å²	96.9	96%	0.958	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	103.4	161	-73.2	-167.5	154.2	0	0	107.6
21	G	42.2	Very low	36.4	Very low	67 Å²	67	95.6 Å²	95.6	69%	0.691	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	144	-2.6	-169	0	0	0	0	0	115.7	F19 L23	F19-G21 PolarHBondContact O-N 3.39Å; G21-L23 VanDerWaalsContact C-N 3.26Å; G21-L23 PolarHBondContact O-N 3.32Å
22	G	34.1	Very low	36.8	Very low	78 Å²	78	96.7 Å²	96.7	80%	0.804	56%	0.563	S	S	*	*	S	Bend	trans	75.9	4.1	167.7	0	0	0	0	0	116.1	F19	F19-G22 PolarHBondContact O-N 2.97Å
23	L	34.3	Very low	36.8	Very low	142 Å²	142	98.9 Å²	98.9	74%	0.743	56%	0.563	S	S	*	*			trans	-89.2	104.6	171.8	-90.5	143.1	0	0	0	110.1	G21 S25	G21-L23 VanDerWaalsContact C-N 3.26Å; G21-L23 PolarHBondContact O-N 3.32Å; L23-S25 PolarHBondContact O-N 3.16Å
24	Q	35.1	Very low	37.3	Very low	174 Å²	174	95.3 Å²	95.3	81%	0.813	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.7	111.9	164.5	-84.2	-176	-18.4	0	0	109.1
25	S	37.2	Very low	37.6	Very low	73 Å²	73	98.4 Å²	98.4	51%	0.51	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	123.9	167.1	175.6	0	0	0	0	109.1	L23	L23-S25 PolarHBondContact O-N 3.16Å
26	S	37	Very low	37.8	Very low	97 Å²	97	102.1 Å²	102.1	68%	0.678	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.4	108.2	170.5	155.7	0	0	0	0	108.6
27	V	36.9	Very low	38	Very low	40 Å²	40	101.4 Å²	101.4	24%	0.242	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.3	115	171.8	-178.4	0	0	0	0	108.5	V29 V45	V27-V29 PolarHBondContact O-N 3.43Å; V27-V45 HydrophobicContact CG1-CG1 3.99Å
28	A	37.2	Very low	38	Very low	47 Å²	47	103.7 Å²	103.7	39%	0.388	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79	109.2	169.3	0	0	0	0	0	108.6	Q30	A28-Q30 PolarHBondContact O-N 3.33Å
29	V	37.3	Very low	37.9	Very low	39 Å²	39	103.6 Å²	103.6	24%	0.236	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.6	110.1	170	-179.2	0	0	0	0	107.1	V27	V27-V29 PolarHBondContact O-N 3.43Å
30	Q	43.7	Very low	37.8	Very low	49 Å²	49	102.4 Å²	102.4	23%	0.229	56%	0.558	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-94	108.3	174.1	-170.2	168.6	-8.5	0	0	108.5	L10 A28 R32 K46	L10-Q30 HydrophobicContact CD2-CG 4.22Å; A28-Q30 PolarHBondContact O-N 3.33Å; Q30-R32 PolarHBondContact O-N 3.36Å; Q30-K46 VanDerWaalsContact OE1-CE 3.23Å
31	E	36.5	Very low	37.5	Very low	66 Å²	66	101.3 Å²	101.3	31%	0.308	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	119.9	169.9	-66.6	-162.5	136.9	0	0	109.1	R41	E31-R41 IonicContact OE1-CZ 3.56Å; E31-R41 IonicContact OE1-NE 3.47Å; E31-R41 PolarHBondContact OE1-NE 3.12Å; E31-R41 IonicContact OE1-NH2 2.8Å; E31-R41 PolarHBondContact OE1-NH2 3.17Å
32	R	41.6	Very low	37.5	Very low	84 Å²	84	100.9 Å²	100.9	32%	0.317	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.4	177.2	-139.4	178	-174	-172.6	-1.5	109.4	Q30 Y169	Q30-R32 PolarHBondContact O-N 3.36Å; R32-Y169 VanDerWaalsContact NH2-CE1 3.32Å
33	W	38.2	Very low	37.6	Very low	155 Å²	155	105.1 Å²	105.1	59%	0.587	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.3	170.7	-63.5	90.1	0	0	0	108.2	L39	W33-L39 HydrophobicContact CE3-CD1 4.5Å; W33-L39 HydrophobicContact CE3-CD2 3.71Å; W33-L39 HydrophobicContact CE3-CG 3.71Å; W33-L39 HydrophobicContact CH2-CD2 3.89Å; W33-L39 HydrophobicContact CZ3-CD2 3.12Å; W33-L39 HydrophobicContact CZ3-CG 3.58Å
34	S	46.4	Very low	38	Very low	63 Å²	63	102.1 Å²	102.1	44%	0.441	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.8	175.1	-177.2	0	0	0	0	109.6
35	W	39.2	Very low	38.2	Very low	160 Å²	160	98.3 Å²	98.3	61%	0.606	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	94.2	177.4	-77.3	85.5	0	0	0	110.1	L144	W35-L144 HydrophobicContact CH2-CD1 3.76Å; W35-L144 HydrophobicContact CZ2-CD1 4.49Å; W35-L144 HydrophobicContact CZ3-CD1 4.22Å
36	R	40	Very low	38.6	Very low	150 Å²	150	100.2 Å²	100.2	57%	0.566	50%	0.495	S	S	*	.	S	Bend	trans	-127.7	78	160.1	-82	-161.5	-168.3	-118.3	2.1	109.2	E38	R36-E38 PolarHBondContact O-N 3.43Å
37	G	38.9	Very low	38.8	Very low	85 Å²	85	103.7 Å²	103.7	88%	0.876	50%	0.5	S	S	*	.	S	Bend	trans	67.2	-24	168	0	0	0	0	0	117.6
38	E	34.2	Very low	38.9	Very low	125 Å²	125	107.8 Å²	107.8	58%	0.584	53%	0.531	S	S	*	.	S	Bend	trans	-144.7	144.6	178.2	-84.8	174.8	163.1	0	0	108.9	R36 Y40	R36-E38 PolarHBondContact O-N 3.43Å; E38-Y40 HydrophobicContact CB-CD2 4.04Å; E38-Y40 HydrophobicContact CB-CE2 3.36Å; E38-Y40 HydrophobicContact CG-CE2 4.49Å; E38-Y40 WeakPolarHBondContact O-CD2 3.43Å; E38-Y40 PolarHBondContact O-N 3.18Å; E38-Y40 PolarHBondContact OE2-OH 3.1Å
39	L	31.9	Very low	38.9	Very low	115 Å²	115	109.2 Å²	109.2	60%	0.602	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	101.2	-174.2	-134.5	85.6	0	0	0	109.2	W33	W33-L39 HydrophobicContact CE3-CD1 4.5Å; W33-L39 HydrophobicContact CE3-CD2 3.71Å; W33-L39 HydrophobicContact CE3-CG 3.71Å; W33-L39 HydrophobicContact CH2-CD2 3.89Å; W33-L39 HydrophobicContact CZ3-CD2 3.12Å; W33-L39 HydrophobicContact CZ3-CG 3.58Å
40	Y	33.5	Very low	39.1	Very low	137 Å²	137	113.4 Å²	113.4	54%	0.537	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.5	135.7	174.5	-66.6	-76.9	0	0	0	112.2	E38 V42	E38-Y40 HydrophobicContact CB-CD2 4.04Å; E38-Y40 HydrophobicContact CB-CE2 3.36Å; E38-Y40 HydrophobicContact CG-CE2 4.49Å; E38-Y40 WeakPolarHBondContact O-CD2 3.43Å; E38-Y40 PolarHBondContact O-N 3.18Å; E38-Y40 PolarHBondContact OE2-OH 3.1Å; Y40-V42 PolarHBondContact O-N 2.81Å
41	R	32	Very low	38.7	Very low	182 Å²	182	118.4 Å²	118.4	69%	0.687	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.3	107.2	176.3	-167.3	-178.8	-154.6	176.5	6	108.9	E31	E31-R41 IonicContact OE1-CZ 3.56Å; E31-R41 IonicContact OE1-NE 3.47Å; E31-R41 PolarHBondContact OE1-NE 3.12Å; E31-R41 IonicContact OE1-NH2 2.8Å; E31-R41 PolarHBondContact OE1-NH2 3.17Å
42	V	42.1	Very low	38.7	Very low	58 Å²	58	124.6 Å²	124.6	35%	0.352	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.8	117.7	173.6	-174.8	0	0	0	0	108.6	Y40 E44	Y40-V42 PolarHBondContact O-N 2.81Å; V42-E44 HydrophobicContact CG1-CG 4.25Å
43	K	37.3	Very low	38.3	Very low	166 Å²	166	131.9 Å²	131.9	72%	0.722	65%	0.651	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.7	101.5	166.6	-77.1	-176.5	175.2	-179	0	108.1
44	E	42.8	Very low	38	Very low	80 Å²	80	128.2 Å²	128.2	37%	0.374	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.7	128.1	168.5	-95.3	-177.1	166.1	0	0	110.3	V42	V42-E44 HydrophobicContact CG1-CG 4.25Å
45	V	38.5	Very low	37.6	Very low	93 Å²	93	131.5 Å²	131.5	56%	0.564	67%	0.674	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92	105.4	168	178.4	0	0	0	0	107	V27 H47	V27-V45 HydrophobicContact CG1-CG1 3.99Å; V45-H47 PolarHBondContact O-N 2.79Å
46	K	46.2	Very low	37.6	Very low	113 Å²	113	130.7 Å²	130.7	49%	0.491	68%	0.68	S	S	.	*			trans	-81.7	112.8	174.1	-83	-174.4	172.6	-178.1	0	110.2	Q30	Q30-K46 VanDerWaalsContact OE1-CE 3.23Å
47	H	40.3	Very low	37.6	Very low	170 Å²	170	131 Å²	131	79%	0.787	69%	0.693	S	S	*	*			trans	-79.8	120.6	161.4	-73.8	-73.9	0	0	0	109.5	V45 A49	V45-H47 PolarHBondContact O-N 2.79Å; H47-A49 PolarHBondContact O-N 3.06Å; H47-A49 VanDerWaalsContact O-N 3.12Å
48	S	38.9	Very low	37.5	Very low	127 Å²	127	130.4 Å²	130.4	89%	0.888	69%	0.687	S	S	*	*			trans	-78.1	85.7	174.6	58	0	0	0	0	110.5
49	A	37.6	Very low	37.6	Very low	77 Å²	77	131.9 Å²	131.9	64%	0.636	70%	0.699	S	S	*	*			trans	-150.6	122.9	157.7	0	0	0	0	0	109.1	H47 L51	H47-A49 PolarHBondContact O-N 3.06Å; H47-A49 VanDerWaalsContact O-N 3.12Å; A49-L51 PolarHBondContact O-N 3.28Å
50	P	41	Very low	38	Very low	127 Å²	127	133.4 Å²	133.4	83%	0.825	71%	0.713	S	S	*	*			trans	-68.3	122.3	173.3	27.1	-30.1	0	0	0	109.3	K52	P50-K52 PolarHBondContact O-N 3.26Å
51	L	36.5	Very low	38.3	Very low	153 Å²	153	133.5 Å²	133.5	80%	0.801	72%	0.723	S	S	*	*			trans	-64	97.6	167.8	-83.5	154.7	0	0	0	108.9	A49 W53	A49-L51 PolarHBondContact O-N 3.28Å; L51-W53 PolarHBondContact O-N 3.33Å
52	K	34.9	Very low	39.1	Very low	196 Å²	196	132.1 Å²	132.1	85%	0.852	73%	0.729	S	S	*	*			trans	-71.5	114.3	160.7	-84.4	-175.9	175.2	-177.9	0	107.8	P50 A54	P50-K52 PolarHBondContact O-N 3.26Å; K52-A54 PolarHBondContact O-N 3.1Å
53	W	34.1	Very low	39	Very low	237 Å²	237	136.1 Å²	136.1	90%	0.898	75%	0.749	S	S	*	*			trans	-74.5	110.7	162	-69.4	74.9	0	0	0	107.5	L51	L51-W53 PolarHBondContact O-N 3.33Å
54	A	32.5	Very low	39.6	Very low	79 Å²	79	134.6 Å²	134.6	65%	0.653	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-102.4	131.3	169.2	0	0	0	0	0	108.5	K52	K52-A54 PolarHBondContact O-N 3.1Å
55	P	36.6	Very low	39.5	Very low	132 Å²	132	136 Å²	136	86%	0.857	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-71.9	131.9	169.1	28.9	-29.1	0	0	0	109.5
56	I	39.8	Very low	39.7	Very low	143 Å²	143	139.9 Å²	139.9	73%	0.733	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-90	119.2	-179.8	-71.6	173.3	0	0	0	108.7
57	N	41	Very low	39.2	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	80%	0.795	S	S	*	*			trans	66.5	140.8	157.6	-50.6	-16.9	0	0	0	116.6
58	G	36.7	Very low	39	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	80%	0.8	S	S	*	*			cis	134.7	114.8	21.2	0	0	0	0	0	107.3
59	D	34.6	Very low	38.7	Very low	156 Å²	156	141.7 Å²	141.7	83%	0.834	79%	0.792	S	S	*	*			trans	-9.3	132.3	178.1	-64.1	-33.9	0	0	0	120.7
60	T	42.1	Very low	38.7	Very low	147 Å²	147	143.6 Å²	143.6	90%	0.902	80%	0.798	S	S	*	*				-165.9	135.2	122.4	6.1	0	0	0	0	111.7
61	N	39.5	Very low	38.4	Very low	139 Å²	139	145.5 Å²	145.5	74%	0.743	80%	0.796	S	S	*	*			trans	-67.4	150.4	-176.3	-55.9	-52.2	0	0	0	113.6
62	D	47.3	Very low	38.4	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	80%	0.795	S	S	*	*				163.1	130.4	105.4	-84.3	-34.2	0	0	0	111.1
63	D	41.2	Very low	39	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	79%	0.79	S	S	*	*			trans	6.1	126.6	150.3	-154.1	21.5	0	0	0	118.9
64	V	50	Low	39.7	Very low	134 Å²	134	141 Å²	141	81%	0.812	79%	0.787	S	S	*	*				173.5	136.6	124.3	160.8	0	0	0	0	110.4
65	T	41.4	Very low	41	Very low	108 Å²	108	141.9 Å²	141.9	66%	0.663	79%	0.785	S	S	*	*			trans	-62	162.1	-173.7	-19.3	0	0	0	0	116.8
66	E	41.7	Very low	42.8	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	77%	0.772	S	S	*	*			trans	90.9	109.9	150.3	-71.1	175	-159.4	0	0	120
67	D	35.1	Very low	44.7	Very low	155 Å²	155	136.8 Å²	136.8	83%	0.829	75%	0.752	S	S	*	*				64.5	99.5	127.3	-147.6	17.6	0	0	0	117.4
68	E	36.2	Very low	46.7	Very low	189 Å²	189	132.3 Å²	132.3	88%	0.883	73%	0.727	S	S	*	*			trans	-171.5	117.5	144.4	-109.1	176.8	-175	0	0	113
69	S	32.6	Very low	48.8	Very low	104 Å²	104	130 Å²	130	73%	0.727	70%	0.699	S	S	*	*			trans	61.9	137.3	136.4	-110.3	0	0	0	0	121.4	E71	S69-E71 PolarHBondContact O-N 3.24Å; S69-E71 VanDerWaalsContact O-N 3.17Å
70	P	39.1	Very low	50.9	Low	118 Å²	118	124.2 Å²	124.2	77%	0.766	67%	0.666	S	S	*	*			trans	-66.6	121.1	179.3	29.8	-32.7	0	0	0	110.2	T72	P70-T72 PolarHBondContact O-N 3Å
71	E	33.1	Very low	52.7	Low	167 Å²	167	124.1 Å²	124.1	78%	0.78	65%	0.653	S	S	*	*			trans	-37.6	101.7	178.4	-63.8	177.3	159.7	0	0	113.4	S69 K73	S69-E71 PolarHBondContact O-N 3.24Å; S69-E71 VanDerWaalsContact O-N 3.17Å; E71-K73 PolarHBondContact O-N 3.15Å
72	T	37.5	Very low	54.6	Low	127 Å²	127	123.2 Å²	123.2	78%	0.779	64%	0.644	S	S	*	*			trans	-68.1	90.9	157.3	45.7	0	0	0	0	107.1	P70 K74	P70-T72 PolarHBondContact O-N 3Å; T72-K74 PolarHBondContact O-N 3.17Å
73	K	46.8	Very low	56.1	Low	174 Å²	174	119 Å²	119	76%	0.757	62%	0.621	S	S	*	*			trans	-54.1	102	171	-72.3	-178.1	179.9	178.4	0	108.2	E71 T75	E71-K73 PolarHBondContact O-N 3.15Å; K73-T75 PolarHBondContact O-N 3.05Å
74	K	49.5	Very low	57.9	Low	189 Å²	189	112.3 Å²	112.3	82%	0.822	59%	0.586	S	S	*	*			trans	-55.2	111.6	177.1	-72.6	175.5	-178.8	171.3	0	107.7	T72 T76	T72-K74 PolarHBondContact O-N 3.17Å; K74-T76 PolarHBondContact O-N 3.39Å
75	T	59.2	Low	59.2	Low	99 Å²	99	107.8 Å²	107.8	61%	0.607	56%	0.562	S	S	*	*			trans	-72.2	94.2	175.9	39.2	0	0	0	0	108.5	K73 F77	K73-T75 PolarHBondContact O-N 3.05Å; T75-F77 PolarHBondContact O-N 2.95Å
76	T	73.7	Confident	61	Low	96 Å²	96	107.5 Å²	107.5	59%	0.589	56%	0.557	S	S	*	*			trans	-79.3	113.2	-179.7	-55.2	0	0	0	0	109.6	K74 L78	K74-T76 PolarHBondContact O-N 3.39Å; T76-L78 HydrophobicContact CG2-CD2 4.14Å; T76-L78 HydrophobicContact CG2-CG 4.19Å
77	F	81.5	Confident	62.7	Low	72 Å²	72	102.9 Å²	102.9	32%	0.316	54%	0.537	S	S	.	.			trans	-76.8	121.4	171	-81.5	-90.8	0	0	0	109.4	T75 C109 K111 Y118 C120	T75-F77 PolarHBondContact O-N 2.95Å; F77-C109 HydrophobicContact CE1-CB 4.49Å; F77-K111 HydrophobicContact CD1-CB 3.78Å; F77-K111 HydrophobicContact CE1-CB 3.66Å; F77-K111 HydrophobicContact CZ-CB 4.42Å; F77-Y118 HydrophobicContact CB-CD1 4.49Å; F77-Y118 HydrophobicContact CB-CG 4.5Å; F77-C120 HydrophobicContact CD1-CB 3.67Å; F77-C120 HydrophobicContact CD2-CB 4.22Å; F77-C120 HydrophobicContact CE1-CB 3.55Å; F77-C120 HydrophobicContact CE2-CB 4.12Å; F77-C120 HydrophobicContact CG-CB 4.01Å; F77-C120 HydrophobicContact CZ-CB 3.8Å
78	L	81.6	Confident	64.5	Low	61 Å²	61	97 Å²	97	32%	0.319	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.2	-178.6	-70.3	167.3	0	0	0	111.2	T76 L83 Y118 Y119	T76-L78 HydrophobicContact CG2-CD2 4.14Å; T76-L78 HydrophobicContact CG2-CG 4.19Å; L78-L83 HydrophobicContact CD1-CD1 4.49Å; L78-Y118 CarbonylContact O-C 3.57Å; L78-Y118 WeakPolarHBondContact O-CA 3.46Å; L78-Y119 PolarHBondContact N-O 3.33Å; L78-Y119 PolarHBondContact O-N 2.8Å
79	P	82.1	Confident	66.5	Low	24 Å²	24	95.6 Å²	95.6	16%	0.156	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	152.4	172.9	30.3	-33.9	0	0	0	110.7	K81 E82 L83 I116 Y118	P79-K81 VanDerWaalsContact C-N 3.31Å; P79-K81 PolarHBondContact O-N 2.81Å; P79-K81 VanDerWaalsContact O-N 3.15Å; P79-E82 VanDerWaalsContact CD-OE2 3.3Å; P79-E82 WeakPolarHBondContact CD-OE2 3.45Å; P79-E82 HydrophobicContact CG-CB 3.98Å; P79-E82 VanDerWaalsContact CG-CD 3.4Å; P79-E82 HydrophobicContact CG-CG 3.77Å; P79-E82 PolarHBondContact O-N 3.17Å; P79-L83 PolarHBondContact O-N 3.13Å; P79-I116 HydrophobicContact CB-CG2 4.07Å; P79-Y118 HydrophobicContact CB-CD1 4.47Å; P79-Y118 HydrophobicContact CB-CE1 4.42Å; P79-Y118 HydrophobicContact CG-CE1 4.5Å
80	Y	79.1	Confident	68.6	Low	35 Å²	35	97.4 Å²	97.4	14%	0.137	50%	0.497	C	S	.	.	H	α-helix	trans	-44.6	-51.6	-177.4	178.7	-102.9	0	0	0	113.4	E82 L83 I84 F100 E101 L104 Y119	Y80-E82 VanDerWaalsContact C-N 3.27Å; Y80-E82 PolarHBondContact O-N 3.33Å; Y80-L83 PolarHBondContact O-N 3.01Å; Y80-L83 VanDerWaalsContact O-N 3.17Å; Y80-I84 HydrophobicContact CD1-CD1 4.07Å; Y80-I84 HydrophobicContact CD1-CG1 4.37Å; Y80-I84 HydrophobicContact CE1-CD1 3.4Å; Y80-I84 HydrophobicContact CE1-CG1 4.17Å; Y80-I84 HydrophobicContact CE2-CD1 3.91Å; Y80-I84 VanDerWaalsContact O-CG1 3.29Å; Y80-I84 WeakPolarHBondContact O-CG1 3.46Å; Y80-I84 PolarHBondContact O-N 3.39Å; Y80-I84 VanDerWaalsContact O-N 3.1Å; Y80-I84 WeakPolarHBondContact OH-CD1 3.3Å; Y80-F100 AromaticContact CE2-CD1 3.65Å; Y80-F100 HydrophobicContact CE2-CD1 3.65Å; Y80-F100 HydrophobicContact CE2-CE1 4.07Å; Y80-F100 AromaticContact CZ-CD1 3.9Å; Y80-F100 VanDerWaalsContact OH-CD1 3.3Å; Y80-F100 WeakPolarHBondContact OH-CD1 3.3Å; Y80-E101 HydrophobicContact CD2-CG 4.43Å; Y80-E101 HydrophobicContact CE2-CB 4.29Å; Y80-L104 HydrophobicContact CD2-CD1 3.56Å; Y80-L104 HydrophobicContact CE2-CD1 3.56Å; Y80-Y119 HydrophobicContact CD2-CE2 4.48Å
81	K	78.4	Confident	70.4	Confident	146 Å²	146	94.7 Å²	94.7	64%	0.635	48%	0.478	S	S	*	.	H	α-helix	trans	-60.3	-33.1	-177	-68.5	-179.6	-179.4	172.4	0	113.9	P79 A85	P79-K81 VanDerWaalsContact C-N 3.31Å; P79-K81 PolarHBondContact O-N 2.81Å; P79-K81 VanDerWaalsContact O-N 3.15Å; K81-A85 WeakPolarHBondContact O-CA 3.36Å; K81-A85 WeakPolarHBondContact O-CB 3.4Å; K81-A85 PolarHBondContact O-N 3.38Å
82	E	79.9	Confident	72.5	Confident	120 Å²	120	91 Å²	91	56%	0.561	47%	0.469	S	S	*	.	H	α-helix	trans	-80	-40.3	177.8	-70.3	175	-163.3	0	0	110.7	P79 Y80 I84 A85	P79-E82 VanDerWaalsContact CD-OE2 3.3Å; P79-E82 WeakPolarHBondContact CD-OE2 3.45Å; P79-E82 HydrophobicContact CG-CB 3.98Å; P79-E82 VanDerWaalsContact CG-CD 3.4Å; P79-E82 HydrophobicContact CG-CG 3.77Å; P79-E82 PolarHBondContact O-N 3.17Å; Y80-E82 VanDerWaalsContact C-N 3.27Å; Y80-E82 PolarHBondContact O-N 3.33Å; E82-I84 VanDerWaalsContact C-N 3.29Å; E82-I84 PolarHBondContact O-N 3.29Å; E82-A85 WeakPolarHBondContact O-CB 3.29Å; E82-A85 PolarHBondContact O-N 3.46Å
83	L	78.7	Confident	74.3	Confident	62 Å²	62	92.7 Å²	92.7	33%	0.325	47%	0.468	S	S	.	.	H	α-helix	trans	-58.8	-40.8	178.9	-170.9	75.7	0	0	0	112.2	L78 P79 Y80 L104	L78-L83 HydrophobicContact CD1-CD1 4.49Å; P79-L83 PolarHBondContact O-N 3.13Å; Y80-L83 PolarHBondContact O-N 3.01Å; Y80-L83 VanDerWaalsContact O-N 3.17Å; L83-L104 HydrophobicContact CD2-CD1 4.08Å; L83-L104 HydrophobicContact CD2-CD2 4.21Å
84	I	78.8	Confident	75.5	Confident	3 Å²	3	86 Å²	86	2%	0.015	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	14.1	-179.1	63.9	163.9	0	0	0	114.1	Y80 E82 D86 I87 L88 F100	Y80-I84 HydrophobicContact CD1-CD1 4.07Å; Y80-I84 HydrophobicContact CD1-CG1 4.37Å; Y80-I84 HydrophobicContact CE1-CD1 3.4Å; Y80-I84 HydrophobicContact CE1-CG1 4.17Å; Y80-I84 HydrophobicContact CE2-CD1 3.91Å; Y80-I84 VanDerWaalsContact O-CG1 3.29Å; Y80-I84 WeakPolarHBondContact O-CG1 3.46Å; Y80-I84 PolarHBondContact O-N 3.39Å; Y80-I84 VanDerWaalsContact O-N 3.1Å; Y80-I84 WeakPolarHBondContact OH-CD1 3.3Å; E82-I84 VanDerWaalsContact C-N 3.29Å; E82-I84 PolarHBondContact O-N 3.29Å; I84-D86 PolarHBondContact O-N 3.26Å; I84-D86 VanDerWaalsContact O-N 3.16Å; I84-I87 HydrophobicContact CB-CB 4.36Å; I84-I87 HydrophobicContact CG2-CD1 4.36Å; I84-I87 PolarHBondContact O-N 3.24Å; I84-L88 HydrophobicContact CB-CG 4.29Å; I84-L88 HydrophobicContact CD1-CD1 3.67Å; I84-L88 HydrophobicContact CD1-CD2 3.62Å; I84-L88 HydrophobicContact CD1-CG 3.52Å; I84-L88 HydrophobicContact CG1-CD1 3.65Å; I84-L88 HydrophobicContact CG1-CD2 4.36Å; I84-L88 HydrophobicContact CG1-CG 3.69Å; I84-L88 WeakPolarHBondContact O-CB 3.31Å; I84-L88 VanDerWaalsContact O-CG 3.31Å; I84-L88 WeakPolarHBondContact O-CG 3.39Å; I84-L88 PolarHBondContact O-N 2.98Å; I84-F100 HydrophobicContact CD1-CE1 4.38Å; I84-F100 HydrophobicContact CG2-CE1 3.58Å; I84-F100 HydrophobicContact CG2-CZ 4.14Å
85	A	77.8	Confident	76.4	Confident	39 Å²	39	84.9 Å²	84.9	32%	0.322	43%	0.431	S	S	.	.	H	α-helix	trans	-53.1	-42.1	-175.4	0	0	0	0	0	112.7	K81 E82 K89	K81-A85 WeakPolarHBondContact O-CA 3.36Å; K81-A85 WeakPolarHBondContact O-CB 3.4Å; K81-A85 PolarHBondContact O-N 3.38Å; E82-A85 WeakPolarHBondContact O-CB 3.29Å; E82-A85 PolarHBondContact O-N 3.46Å; A85-K89 WeakPolarHBondContact O-CG 3.29Å; A85-K89 PolarHBondContact O-N 3.21Å
86	D	78.6	Confident	77	Confident	102 Å²	102	88.4 Å²	88.4	55%	0.545	44%	0.44	S	S	.	.	H	α-helix	trans	-76.5	-34.5	179.3	-68.1	-31.2	0	0	0	113.1	I84 K89	I84-D86 PolarHBondContact O-N 3.26Å; I84-D86 VanDerWaalsContact O-N 3.16Å; D86-K89 PolarHBondContact O-N 2.81Å; D86-K89 IonicContact OD1-NZ 2.78Å; D86-K89 PolarHBondContact OD1-NZ 2.81Å
87	I	77.8	Confident	77	Confident	79 Å²	79	86.1 Å²	86.1	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-68.6	-39	175.7	-60.6	172.7	0	0	0	110.1	I84 K89 L90 V91 L94	I84-I87 HydrophobicContact CB-CB 4.36Å; I84-I87 HydrophobicContact CG2-CD1 4.36Å; I84-I87 PolarHBondContact O-N 3.24Å; I87-K89 VanDerWaalsContact C-N 3.26Å; I87-K89 PolarHBondContact O-N 2.79Å; I87-L90 PolarHBondContact O-N 2.93Å; I87-L90 VanDerWaalsContact O-N 3.09Å; I87-V91 PolarHBondContact O-N 2.87Å; I87-L94 HydrophobicContact CG2-CD2 3.82Å
88	L	73.4	Confident	76.6	Confident	32 Å²	32	88.6 Å²	88.6	17%	0.168	44%	0.441	C	S	.	.	H	α-helix	trans	-64.7	-27.6	177.6	-74.4	179.9	0	0	0	113.1	I84 L90 V91 P92 L94 R95	I84-L88 HydrophobicContact CB-CG 4.29Å; I84-L88 HydrophobicContact CD1-CD1 3.67Å; I84-L88 HydrophobicContact CD1-CD2 3.62Å; I84-L88 HydrophobicContact CD1-CG 3.52Å; I84-L88 HydrophobicContact CG1-CD1 3.65Å; I84-L88 HydrophobicContact CG1-CD2 4.36Å; I84-L88 HydrophobicContact CG1-CG 3.69Å; I84-L88 WeakPolarHBondContact O-CB 3.31Å; I84-L88 VanDerWaalsContact O-CG 3.31Å; I84-L88 WeakPolarHBondContact O-CG 3.39Å; I84-L88 PolarHBondContact O-N 2.98Å; L88-L90 VanDerWaalsContact C-N 3.33Å; L88-V91 CarbonylContact O-C 3.57Å; L88-P92 WeakPolarHBondContact O-CA 3.43Å; L88-L94 HydrophobicContact CD2-CB 4.23Å; L88-R95 HydrophobicContact CD2-CB 3.74Å; L88-R95 HydrophobicContact CD2-CG 4.38Å
89	K	78.5	Confident	76.4	Confident	158 Å²	158	90.1 Å²	90.1	69%	0.687	45%	0.449	S	S	*	.	H	α-helix	trans	-66.4	-37.3	172.5	-68.9	168.8	-168.6	161.4	0	111.5	A85 D86 I87	A85-K89 WeakPolarHBondContact O-CG 3.29Å; A85-K89 PolarHBondContact O-N 3.21Å; D86-K89 PolarHBondContact O-N 2.81Å; D86-K89 IonicContact OD1-NZ 2.78Å; D86-K89 PolarHBondContact OD1-NZ 2.81Å; I87-K89 VanDerWaalsContact C-N 3.26Å; I87-K89 PolarHBondContact O-N 2.79Å
90	L	76.6	Confident	76.2	Confident	142 Å²	142	90.8 Å²	90.8	74%	0.743	45%	0.45	S	S	*	.	H	α-helix	trans	-83.8	-38.3	-179.4	-65.1	174.8	0	0	0	112.3	I87 L88	I87-L90 PolarHBondContact O-N 2.93Å; I87-L90 VanDerWaalsContact O-N 3.09Å; L88-L90 VanDerWaalsContact C-N 3.33Å
91	V	76.6	Confident	76	Confident	62 Å²	62	92.9 Å²	92.9	38%	0.376	46%	0.461	S	S	.	.			trans	-132	79.2	-175.3	-170.5	0	0	0	0	109	I87 L88 Q93 L94	I87-V91 PolarHBondContact O-N 2.87Å; L88-V91 CarbonylContact O-C 3.57Å; V91-Q93 HydrophobicContact CG1-CB 4.38Å; V91-Q93 PolarHBondContact O-N 2.8Å; V91-L94 HydrophobicContact CG1-CB 4.28Å; V91-L94 WeakPolarHBondContact O-CB 3.3Å; V91-L94 PolarHBondContact O-N 3Å; V91-L94 VanDerWaalsContact O-N 3.1Å
92	P	76.2	Confident	76.2	Confident	90 Å²	90	90.2 Å²	90.2	58%	0.584	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-62	-26.4	-179.3	23.1	-33.1	0	0	0	112.6	L88 L94 R95	L88-P92 WeakPolarHBondContact O-CA 3.43Å; P92-L94 PolarHBondContact O-N 2.92Å; P92-L94 VanDerWaalsContact O-N 3.17Å; P92-R95 VanDerWaalsContact O-CB 3.29Å; P92-R95 WeakPolarHBondContact O-CB 3.39Å; P92-R95 PolarHBondContact O-N 2.96Å; P92-R95 VanDerWaalsContact O-N 3.12Å
93	Q	75	Confident	76.2	Confident	161 Å²	161	86 Å²	86	75%	0.752	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-60.3	-22.7	176.4	-66.4	178.9	-19.5	0	0	113.4	V91 R95	V91-Q93 HydrophobicContact CG1-CB 4.38Å; V91-Q93 PolarHBondContact O-N 2.8Å; Q93-R95 PolarHBondContact O-N 3.47Å
94	L	72.6	Confident	76.3	Confident	35 Å²	35	84.1 Å²	84.1	18%	0.183	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-69.5	-17.1	179.1	-142.9	75.4	0	0	0	112.5	I87 L88 V91 P92 E96 N97 F100	I87-L94 HydrophobicContact CG2-CD2 3.82Å; L88-L94 HydrophobicContact CD2-CB 4.23Å; V91-L94 HydrophobicContact CG1-CB 4.28Å; V91-L94 WeakPolarHBondContact O-CB 3.3Å; V91-L94 PolarHBondContact O-N 3Å; V91-L94 VanDerWaalsContact O-N 3.1Å; P92-L94 PolarHBondContact O-N 2.92Å; P92-L94 VanDerWaalsContact O-N 3.17Å; L94-E96 VanDerWaalsContact C-N 3.32Å; L94-E96 PolarHBondContact O-N 3.17Å; L94-N97 PolarHBondContact O-N 3.4Å; L94-F100 HydrophobicContact CD1-CD2 4.46Å; L94-F100 HydrophobicContact CD2-CD1 4.1Å; L94-F100 HydrophobicContact CD2-CD2 3.92Å; L94-F100 HydrophobicContact CD2-CE1 4.05Å; L94-F100 HydrophobicContact CD2-CE2 3.84Å; L94-F100 HydrophobicContact CD2-CG 4.04Å; L94-F100 HydrophobicContact CD2-CZ 3.91Å; L94-F100 HydrophobicContact CG-CD1 4.46Å; L94-F100 HydrophobicContact CG-CD2 4.24Å; L94-F100 HydrophobicContact CG-CG 4.14Å
95	R	69.5	Low	76.5	Confident	165 Å²	165	86.1 Å²	86.1	62%	0.623	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-67.2	-32.4	-179.1	-165.6	173.5	176.7	179.3	-3.4	113.3	L88 P92 Q93	L88-R95 HydrophobicContact CD2-CB 3.74Å; L88-R95 HydrophobicContact CD2-CG 4.38Å; P92-R95 VanDerWaalsContact O-CB 3.29Å; P92-R95 WeakPolarHBondContact O-CB 3.39Å; P92-R95 PolarHBondContact O-N 2.96Å; P92-R95 VanDerWaalsContact O-N 3.12Å; Q93-R95 PolarHBondContact O-N 3.47Å
96	E	71.9	Confident	76.7	Confident	173 Å²	173	88.5 Å²	88.5	81%	0.808	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-91.4	-5.1	-177.7	-63.2	179.2	177.9	0	0	112.2	L94 N98	L94-E96 VanDerWaalsContact C-N 3.32Å; L94-E96 PolarHBondContact O-N 3.17Å; E96-N98 PolarHBondContact O-N 3.22Å
97	N	73.3	Confident	76.9	Confident	47 Å²	47	84.8 Å²	84.8	25%	0.251	43%	0.433	S	S	.	.			trans	-86.5	96.3	-176.1	-166.1	-14.6	0	0	0	111.4	L94 D99 F100	L94-N97 PolarHBondContact O-N 3.4Å; N97-D99 PolarHBondContact O-N 3.01Å; N97-D99 VanDerWaalsContact OD1-CB 3.24Å; N97-D99 WeakPolarHBondContact OD1-CB 3.37Å; N97-D99 PolarHBondContact OD1-N 3.21Å; N97-F100 HydrophobicContact CB-CB 4.42Å; N97-F100 WeakPolarHBondContact O-CB 3.34Å; N97-F100 PolarHBondContact O-N 3.34Å; N97-F100 VanDerWaalsContact O-N 3.08Å
98	N	72.7	Confident	77.3	Confident	124 Å²	124	81.3 Å²	81.3	66%	0.663	42%	0.416	S	S	*	.	H	α-helix	trans	-60.1	-24.8	175.2	-66.4	-24	0	0	0	113	E96 F100 E101	E96-N98 PolarHBondContact O-N 3.22Å; N98-F100 PolarHBondContact O-N 2.92Å; N98-E101 PolarHBondContact O-N 2.88Å
99	D	78	Confident	77.8	Confident	93 Å²	93	81.1 Å²	81.1	50%	0.497	42%	0.417	S	S	.	.	H	α-helix	trans	-70.9	-21.1	178.4	-58.8	-24.2	0	0	0	112.1	N97 T102 S103	N97-D99 PolarHBondContact O-N 3.01Å; N97-D99 VanDerWaalsContact OD1-CB 3.24Å; N97-D99 WeakPolarHBondContact OD1-CB 3.37Å; N97-D99 PolarHBondContact OD1-N 3.21Å; D99-T102 WeakPolarHBondContact CA-OG1 3.41Å; D99-T102 PolarHBondContact O-OG1 3.44Å; D99-S103 VanDerWaalsContact O-CB 3.3Å; D99-S103 WeakPolarHBondContact O-CB 3.45Å; D99-S103 PolarHBondContact O-N 3.08Å; D99-S103 PolarHBondContact O-OG 3.27Å
100	F	76.2	Confident	78.2	Confident	38 Å²	38	77 Å²	77	17%	0.167	41%	0.406	C	S	.	.	H	α-helix	trans	-73.3	-37.8	179.6	-171.4	-100.3	0	0	0	111.2	Y80 I84 L94 N97 N98 S103 L104	Y80-F100 AromaticContact CE2-CD1 3.65Å; Y80-F100 HydrophobicContact CE2-CD1 3.65Å; Y80-F100 HydrophobicContact CE2-CE1 4.07Å; Y80-F100 AromaticContact CZ-CD1 3.9Å; Y80-F100 VanDerWaalsContact OH-CD1 3.3Å; Y80-F100 WeakPolarHBondContact OH-CD1 3.3Å; I84-F100 HydrophobicContact CD1-CE1 4.38Å; I84-F100 HydrophobicContact CG2-CE1 3.58Å; I84-F100 HydrophobicContact CG2-CZ 4.14Å; L94-F100 HydrophobicContact CD1-CD2 4.46Å; L94-F100 HydrophobicContact CD2-CD1 4.1Å; L94-F100 HydrophobicContact CD2-CD2 3.92Å; L94-F100 HydrophobicContact CD2-CE1 4.05Å; L94-F100 HydrophobicContact CD2-CE2 3.84Å; L94-F100 HydrophobicContact CD2-CG 4.04Å; L94-F100 HydrophobicContact CD2-CZ 3.91Å; L94-F100 HydrophobicContact CG-CD1 4.46Å; L94-F100 HydrophobicContact CG-CD2 4.24Å; L94-F100 HydrophobicContact CG-CG 4.14Å; N97-F100 HydrophobicContact CB-CB 4.42Å; N97-F100 WeakPolarHBondContact O-CB 3.34Å; N97-F100 PolarHBondContact O-N 3.34Å; N97-F100 VanDerWaalsContact O-N 3.08Å; N98-F100 PolarHBondContact O-N 2.92Å; F100-S103 PolarHBondContact O-N 3.07Å; F100-L104 HydrophobicContact CD1-CD1 4.03Å; F100-L104 HydrophobicContact CD1-CG 4.17Å; F100-L104 HydrophobicContact CE1-CD1 3.62Å; F100-L104 HydrophobicContact CE1-CD2 4.1Å; F100-L104 HydrophobicContact CE1-CG 3.75Å; F100-L104 HydrophobicContact CZ-CD1 4.42Å; F100-L104 HydrophobicContact CZ-CD2 4.08Å; F100-L104 HydrophobicContact CZ-CG 4.14Å; F100-L104 WeakPolarHBondContact O-CG 3.42Å; F100-L104 PolarHBondContact O-N 3.02Å
101	E	76.7	Confident	78.6	Confident	79 Å²	79	75.1 Å²	75.1	37%	0.369	39%	0.391	S	S	.	.	H	α-helix	trans	-64.1	-42.3	176	-165.9	178.8	165.4	0	0	111.8	Y80 N98 L104 A105 Y119	Y80-E101 HydrophobicContact CD2-CG 4.43Å; Y80-E101 HydrophobicContact CE2-CB 4.29Å; N98-E101 PolarHBondContact O-N 2.88Å; E101-L104 PolarHBondContact O-N 3.26Å; E101-A105 PolarHBondContact O-N 2.72Å; E101-Y119 WeakPolarHBondContact CG-OH 3.47Å; E101-Y119 PolarHBondContact OE1-OH 3.19Å
102	T	80.7	Confident	79	Confident	90 Å²	90	77.6 Å²	77.6	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-67.9	-35.9	175.1	57.1	0	0	0	0	112	D99 A105	D99-T102 WeakPolarHBondContact CA-OG1 3.41Å; D99-T102 PolarHBondContact O-OG1 3.44Å; T102-A105 PolarHBondContact O-N 3.18Å
103	S	80	Confident	79.2	Confident	33 Å²	33	77.1 Å²	77.1	23%	0.231	39%	0.394	C	S	.	.	H	α-helix	trans	-66.3	-37.4	174.2	-59.2	0	0	0	0	112.1	D99 F100 A105 Q106	D99-S103 VanDerWaalsContact O-CB 3.3Å; D99-S103 WeakPolarHBondContact O-CB 3.45Å; D99-S103 PolarHBondContact O-N 3.08Å; D99-S103 PolarHBondContact O-OG 3.27Å; F100-S103 PolarHBondContact O-N 3.07Å; S103-A105 VanDerWaalsContact C-N 3.3Å; S103-A105 PolarHBondContact O-N 2.81Å; S103-Q106 WeakPolarHBondContact O-CB 3.24Å; S103-Q106 PolarHBondContact O-N 3.33Å; S103-Q106 VanDerWaalsContact O-N 3.15Å
104	L	82.2	Confident	79.4	Confident	22 Å²	22	79.7 Å²	79.7	12%	0.115	40%	0.403	C	S	.	.	H	α-helix	trans	-63.2	-36.1	175.8	-80.1	178.1	0	0	0	112.1	Y80 L83 F100 E101 Q106 V107 C108 Y119	Y80-L104 HydrophobicContact CD2-CD1 3.56Å; Y80-L104 HydrophobicContact CE2-CD1 3.56Å; L83-L104 HydrophobicContact CD2-CD1 4.08Å; L83-L104 HydrophobicContact CD2-CD2 4.21Å; F100-L104 HydrophobicContact CD1-CD1 4.03Å; F100-L104 HydrophobicContact CD1-CG 4.17Å; F100-L104 HydrophobicContact CE1-CD1 3.62Å; F100-L104 HydrophobicContact CE1-CD2 4.1Å; F100-L104 HydrophobicContact CE1-CG 3.75Å; F100-L104 HydrophobicContact CZ-CD1 4.42Å; F100-L104 HydrophobicContact CZ-CD2 4.08Å; F100-L104 HydrophobicContact CZ-CG 4.14Å; F100-L104 WeakPolarHBondContact O-CG 3.42Å; F100-L104 PolarHBondContact O-N 3.02Å; E101-L104 PolarHBondContact O-N 3.26Å; L104-Q106 PolarHBondContact O-N 3.36Å; L104-Q106 VanDerWaalsContact O-N 3.13Å; L104-V107 PolarHBondContact O-N 3.43Å; L104-C108 WeakPolarHBondContact O-CB 3.45Å; L104-C108 PolarHBondContact O-N 3.01Å; L104-Y119 HydrophobicContact CB-CD1 4.16Å; L104-Y119 HydrophobicContact CB-CE1 4.12Å
105	A	81.6	Confident	79.9	Confident	44 Å²	44	82 Å²	82	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-62.3	-18.3	176.7	0	0	0	0	0	113.4	E101 T102 S103 T110	E101-A105 PolarHBondContact O-N 2.72Å; T102-A105 PolarHBondContact O-N 3.18Å; S103-A105 VanDerWaalsContact C-N 3.3Å; S103-A105 PolarHBondContact O-N 2.81Å; A105-T110 HydrophobicContact CB-CG2 4.14Å
106	Q	82.1	Confident	80.5	Confident	89 Å²	89	78 Å²	78	42%	0.416	43%	0.426	S	S	.	.	H	α-helix	trans	-80.1	-24.6	174.4	-58.7	-175.4	-32.8	0	0	112.9	S103 L104 W129	S103-Q106 WeakPolarHBondContact O-CB 3.24Å; S103-Q106 PolarHBondContact O-N 3.33Å; S103-Q106 VanDerWaalsContact O-N 3.15Å; L104-Q106 PolarHBondContact O-N 3.36Å; L104-Q106 VanDerWaalsContact O-N 3.13Å; Q106-W129 HydrophobicContact CB-CG 4.28Å
107	V	84.6	Confident	81.1	Confident	24 Å²	24	71.6 Å²	71.6	15%	0.145	40%	0.398	C	S	.	.	H	α-helix	trans	-110.3	-20.5	-173.4	-178.3	0	0	0	0	111.9	L104 Y121 C126 W129	L104-V107 PolarHBondContact O-N 3.43Å; V107-Y121 HydrophobicContact CG1-CD2 4.2Å; V107-Y121 HydrophobicContact CG1-CE2 4.05Å; V107-C126 HydrophobicContact CG1-CB 3.7Å; V107-W129 HydrophobicContact CG2-CB 4.28Å; V107-W129 HydrophobicContact CG2-CD2 3.81Å; V107-W129 HydrophobicContact CG2-CE3 3.9Å; V107-W129 HydrophobicContact CG2-CG 3.98Å
108	C	85.5	Confident	81.6	Confident	7 Å²	7	72.2 Å²	72.2	5%	0.047	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.4	-176.5	-61.1	0	0	0	0	111.8	L104 Y119 C120	L104-C108 WeakPolarHBondContact O-CB 3.45Å; L104-C108 PolarHBondContact O-N 3.01Å; C108-Y119 HydrophobicContact CB-CD1 4.11Å; C108-C120 CarbonylContact C-O 3.49Å; C108-C120 VanDerWaalsContact CA-O 3.26Å; C108-C120 WeakPolarHBondContact CA-O 3.43Å; C108-C120 WeakPolarHBondContact CB-O 3.08Å
109	C	84.5	Confident	82.2	Confident	27 Å²	27	66.7 Å²	66.7	18%	0.182	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	128.8	164.5	-62.6	0	0	0	0	109.7	F77 Y119 C120 R122	F77-C109 HydrophobicContact CE1-CB 4.49Å; C109-Y119 CarbonylContact O-C 3.49Å; C109-Y119 WeakPolarHBondContact O-CA 3.35Å; C109-C120 PolarHBondContact N-O 3.15Å; C109-C120 PolarHBondContact O-N 2.74Å; C109-R122 PolarHBondContact SG-NE 3.13Å
110	T	86	Confident	82.5	Confident	73 Å²	73	62.9 Å²	62.9	45%	0.448	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	136.8	178	55.2	0	0	0	0	111.2	A105 T117 Y118 Y119	A105-T110 HydrophobicContact CB-CG2 4.14Å; T110-T117 HydrophobicContact CG2-CG2 4.13Å; T110-Y118 CarbonylContact C-O 3.6Å; T110-Y118 VanDerWaalsContact CA-O 3.3Å; T110-Y118 WeakPolarHBondContact CA-O 3.43Å; T110-Y119 HydrophobicContact CG2-CD1 3.73Å; T110-Y119 HydrophobicContact CG2-CE1 3.6Å
111	K	85.5	Confident	82.9	Confident	102 Å²	102	66.3 Å²	66.3	44%	0.443	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	122.9	171.1	-170.1	-179	-176.3	-179.9	0	109.3	F77 L113 Y118	F77-K111 HydrophobicContact CD1-CB 3.78Å; F77-K111 HydrophobicContact CE1-CB 3.66Å; F77-K111 HydrophobicContact CZ-CB 4.42Å; K111-L113 HydrophobicContact CD-CD1 4.03Å; K111-L113 HydrophobicContact CD-CG 4.29Å; K111-L113 HydrophobicContact CG-CD1 4.44Å; K111-L113 HydrophobicContact CG-CG 4.2Å; K111-Y118 PolarHBondContact N-O 3.35Å; K111-Y118 PolarHBondContact O-N 3.44Å
112	N	85.2	Confident	83.2	Confident	114 Å²	114	68.7 Å²	68.7	61%	0.61	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.6	177.4	-67.2	-27.5	0	0	0	109.8	T117	N112-T117 WeakPolarHBondContact OD1-CB 3.43Å; N112-T117 WeakPolarHBondContact OD1-CG2 3.35Å; N112-T117 PolarHBondContact OD1-OG1 2.94Å
113	L	80.3	Confident	83.3	Confident	79 Å²	79	67.9 Å²	67.9	41%	0.414	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.7	176.1	-68.5	173.8	0	0	0	109.6	K111 G115 I116 Y118	K111-L113 HydrophobicContact CD-CD1 4.03Å; K111-L113 HydrophobicContact CD-CG 4.29Å; K111-L113 HydrophobicContact CG-CD1 4.44Å; K111-L113 HydrophobicContact CG-CG 4.2Å; L113-G115 PolarHBondContact O-N 3.15Å; L113-I116 PolarHBondContact N-O 3.47Å; L113-I116 PolarHBondContact O-N 3.09Å; L113-Y118 HydrophobicContact CB-CD2 4.14Å; L113-Y118 HydrophobicContact CB-CE2 3.82Å
114	K	79.4	Confident	83.6	Confident	215 Å²	215	72.9 Å²	72.9	94%	0.935	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	37.5	178.5	-58	-177.7	177.8	-179.7	0	113.9	I116	K114-I116 VanDerWaalsContact C-N 3.26Å; K114-I116 PolarHBondContact O-N 2.96Å
115	G	81.8	Confident	83.8	Confident	85 Å²	85	74.9 Å²	74.9	88%	0.876	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	5.3	-178.9	0	0	0	0	0	115.2	L113	L113-G115 PolarHBondContact O-N 3.15Å
116	I	82.4	Confident	84	Confident	81 Å²	81	73.4 Å²	73.4	42%	0.415	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.3	175	-59.6	168.4	0	0	0	108.4	P79 L113 K114 Y118	P79-I116 HydrophobicContact CB-CG2 4.07Å; L113-I116 PolarHBondContact N-O 3.47Å; L113-I116 PolarHBondContact O-N 3.09Å; K114-I116 VanDerWaalsContact C-N 3.26Å; K114-I116 PolarHBondContact O-N 2.96Å; I116-Y118 HydrophobicContact CB-CD2 4.47Å; I116-Y118 HydrophobicContact CB-CE2 3.78Å; I116-Y118 HydrophobicContact CG2-CD2 4.17Å; I116-Y118 HydrophobicContact CG2-CE2 3.7Å; I116-Y118 WeakPolarHBondContact O-CD2 3.26Å
117	T	83.5	Confident	84.3	Confident	37 Å²	37	70.1 Å²	70.1	23%	0.227	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	121.4	172.4	-55.3	0	0	0	0	109.6	T110 N112 Y119	T110-T117 HydrophobicContact CG2-CG2 4.13Å; N112-T117 WeakPolarHBondContact OD1-CB 3.43Å; N112-T117 WeakPolarHBondContact OD1-CG2 3.35Å; N112-T117 PolarHBondContact OD1-OG1 2.94Å; T117-Y119 HydrophobicContact CG2-CE1 4.12Å; T117-Y119 HydrophobicContact CG2-CE2 3.76Å; T117-Y119 WeakPolarHBondContact CG2-OH 3.35Å; T117-Y119 WeakPolarHBondContact O-CE2 3.38Å
118	Y	83.8	Confident	84.4	Confident	61 Å²	61	72 Å²	72	24%	0.239	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	141.5	174.3	-63	-103.6	0	0	0	109.8	F77 L78 P79 T110 K111 L113 I116	F77-Y118 HydrophobicContact CB-CD1 4.49Å; F77-Y118 HydrophobicContact CB-CG 4.5Å; L78-Y118 CarbonylContact O-C 3.57Å; L78-Y118 WeakPolarHBondContact O-CA 3.46Å; P79-Y118 HydrophobicContact CB-CD1 4.47Å; P79-Y118 HydrophobicContact CB-CE1 4.42Å; P79-Y118 HydrophobicContact CG-CE1 4.5Å; T110-Y118 CarbonylContact C-O 3.6Å; T110-Y118 VanDerWaalsContact CA-O 3.3Å; T110-Y118 WeakPolarHBondContact CA-O 3.43Å; K111-Y118 PolarHBondContact N-O 3.35Å; K111-Y118 PolarHBondContact O-N 3.44Å; L113-Y118 HydrophobicContact CB-CD2 4.14Å; L113-Y118 HydrophobicContact CB-CE2 3.82Å; I116-Y118 HydrophobicContact CB-CD2 4.47Å; I116-Y118 HydrophobicContact CB-CE2 3.78Å; I116-Y118 HydrophobicContact CG2-CD2 4.17Å; I116-Y118 HydrophobicContact CG2-CE2 3.7Å; I116-Y118 WeakPolarHBondContact O-CD2 3.26Å
119	Y	86.3	Confident	84.6	Confident	7 Å²	7	74.9 Å²	74.9	3%	0.027	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	137.9	-177.2	-59.1	-95.9	0	0	0	109.2	L78 Y80 E101 L104 C108 C109 T110 T117	L78-Y119 PolarHBondContact N-O 3.33Å; L78-Y119 PolarHBondContact O-N 2.8Å; Y80-Y119 HydrophobicContact CD2-CE2 4.48Å; E101-Y119 WeakPolarHBondContact CG-OH 3.47Å; E101-Y119 PolarHBondContact OE1-OH 3.19Å; L104-Y119 HydrophobicContact CB-CD1 4.16Å; L104-Y119 HydrophobicContact CB-CE1 4.12Å; C108-Y119 HydrophobicContact CB-CD1 4.11Å; C109-Y119 CarbonylContact O-C 3.49Å; C109-Y119 WeakPolarHBondContact O-CA 3.35Å; T110-Y119 HydrophobicContact CG2-CD1 3.73Å; T110-Y119 HydrophobicContact CG2-CE1 3.6Å; T117-Y119 HydrophobicContact CG2-CE1 4.12Å; T117-Y119 HydrophobicContact CG2-CE2 3.76Å; T117-Y119 WeakPolarHBondContact CG2-OH 3.35Å; T117-Y119 WeakPolarHBondContact O-CE2 3.38Å
120	C	84	Confident	84.8	Confident	13 Å²	13	73.8 Å²	73.8	9%	0.088	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.4	169.3	180	0	0	0	0	108.5	F77 C108 C109 R122	F77-C120 HydrophobicContact CD1-CB 3.67Å; F77-C120 HydrophobicContact CD2-CB 4.22Å; F77-C120 HydrophobicContact CE1-CB 3.55Å; F77-C120 HydrophobicContact CE2-CB 4.12Å; F77-C120 HydrophobicContact CG-CB 4.01Å; F77-C120 HydrophobicContact CZ-CB 3.8Å; C108-C120 CarbonylContact C-O 3.49Å; C108-C120 VanDerWaalsContact CA-O 3.26Å; C108-C120 WeakPolarHBondContact CA-O 3.43Å; C108-C120 WeakPolarHBondContact CB-O 3.08Å; C109-C120 PolarHBondContact N-O 3.15Å; C109-C120 PolarHBondContact O-N 2.74Å; C120-R122 PolarHBondContact O-N 3.21Å
121	Y	85	Confident	84.9	Confident	111 Å²	111	71.4 Å²	71.4	44%	0.435	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	130.1	174.5	175.9	-106.3	0	0	0	110.3	V107 E123 C126 M174	V107-Y121 HydrophobicContact CG1-CD2 4.2Å; V107-Y121 HydrophobicContact CG1-CE2 4.05Å; Y121-E123 HydrophobicContact CE1-CB 4.12Å; Y121-C126 HydrophobicContact CE2-CB 3.73Å; Y121-M174 WeakPolarHBondContact OH-CE 3.46Å; Y121-M174 PolarHBondContact OH-SD 2.89Å
122	R	83.7	Confident	85.1	Confident	129 Å²	129	71.2 Å²	71.2	49%	0.487	36%	0.361	S	S	.	.			trans	-126.3	115.8	172	-176.6	176.2	-76.9	-152	4	108.6	C109 C120 E124 M125 C126	C109-R122 PolarHBondContact SG-NE 3.13Å; C120-R122 PolarHBondContact O-N 3.21Å; R122-E124 VanDerWaalsContact C-N 3.28Å; R122-E124 HydrophobicContact CG-CB 4.28Å; R122-E124 PolarHBondContact O-N 2.74Å; R122-M125 HydrophobicContact CB-CB 4.34Å; R122-M125 HydrophobicContact CB-CG 4.21Å; R122-M125 HydrophobicContact CB-SD 4.47Å; R122-M125 HydrophobicContact CG-CG 4.28Å; R122-M125 PolarHBondContact O-N 2.83Å; R122-M125 VanDerWaalsContact O-N 3.11Å; R122-C126 PolarHBondContact O-N 3.19Å; R122-C126 VanDerWaalsContact O-N 3.08Å
123	E	82.1	Confident	85.3	Confident	73 Å²	73	67.7 Å²	67.7	34%	0.341	34%	0.341	S	S	.	.	H	α-helix	trans	-57	-40.8	-176.7	-176.6	175.7	150.8	0	0	112.9	Y121 M125 C126 L127 K177	Y121-E123 HydrophobicContact CE1-CB 4.12Å; E123-M125 VanDerWaalsContact C-N 3.33Å; E123-M125 PolarHBondContact O-N 2.73Å; E123-C126 WeakPolarHBondContact O-CB 3.11Å; E123-C126 PolarHBondContact O-N 2.75Å; E123-L127 HydrophobicContact CG-CD1 4.13Å; E123-L127 HydrophobicContact CG-CG 4.42Å; E123-L127 WeakPolarHBondContact O-CG 3.38Å; E123-L127 PolarHBondContact O-N 2.71Å; E123-K177 WeakPolarHBondContact OE1-CD 3.4Å; E123-K177 WeakPolarHBondContact OE1-CE 3.49Å; E123-K177 IonicContact OE1-NZ 2.74Å; E123-K177 PolarHBondContact OE1-NZ 3.02Å; E123-K177 IonicContact OE2-NZ 2.73Å; E123-K177 PolarHBondContact OE2-NZ 3.36Å
124	E	86.3	Confident	85.7	Confident	138 Å²	138	64 Å²	64	65%	0.645	32%	0.321	S	S	*	.	H	α-helix	trans	-60	-41.2	178	-61.5	173.3	165.9	0	0	112.5	R122 L127 S128	R122-E124 VanDerWaalsContact C-N 3.28Å; R122-E124 HydrophobicContact CG-CB 4.28Å; R122-E124 PolarHBondContact O-N 2.74Å; E124-L127 PolarHBondContact O-N 3.34Å; E124-S128 WeakPolarHBondContact O-CB 3.04Å; E124-S128 PolarHBondContact O-N 3.02Å
125	M	86.2	Confident	86.1	Confident	64 Å²	64	57.3 Å²	57.3	32%	0.315	29%	0.294	S	S	.	.	H	α-helix	trans	-68	-40.7	176.5	-69.6	-169.9	74.6	0	0	110.9	R122 E123 L127 S128 W129	R122-M125 HydrophobicContact CB-CB 4.34Å; R122-M125 HydrophobicContact CB-CG 4.21Å; R122-M125 HydrophobicContact CB-SD 4.47Å; R122-M125 HydrophobicContact CG-CG 4.28Å; R122-M125 PolarHBondContact O-N 2.83Å; R122-M125 VanDerWaalsContact O-N 3.11Å; E123-M125 VanDerWaalsContact C-N 3.33Å; E123-M125 PolarHBondContact O-N 2.73Å; M125-L127 PolarHBondContact O-N 2.67Å; M125-S128 PolarHBondContact O-N 2.56Å; M125-W129 VanDerWaalsContact O-CB 3.31Å; M125-W129 WeakPolarHBondContact O-CB 3.39Å; M125-W129 PolarHBondContact O-N 2.93Å
126	C	86.6	Confident	86.5	Confident	13 Å²	13	58.1 Å²	58.1	9%	0.088	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-46.7	174.1	-167.2	0	0	0	0	112	V107 Y121 R122 E123 W129 L130 M174	V107-C126 HydrophobicContact CG1-CB 3.7Å; Y121-C126 HydrophobicContact CE2-CB 3.73Å; R122-C126 PolarHBondContact O-N 3.19Å; R122-C126 VanDerWaalsContact O-N 3.08Å; E123-C126 WeakPolarHBondContact O-CB 3.11Å; E123-C126 PolarHBondContact O-N 2.75Å; C126-W129 PolarHBondContact O-N 3.48Å; C126-L130 WeakPolarHBondContact O-CB 3.43Å; C126-L130 VanDerWaalsContact O-CG 3.27Å; C126-L130 WeakPolarHBondContact O-CG 3.31Å; C126-L130 PolarHBondContact O-N 3.28Å; C126-M174 HydrophobicContact CB-CE 4.09Å; C126-M174 VanDerWaalsContact SG-CE 3.56Å
127	L	87.3	Confident	86.7	Confident	19 Å²	19	57.4 Å²	57.4	10%	0.099	27%	0.267	C	S	.	.	H	α-helix	trans	-65	-42.5	178.9	-72.4	173.2	0	0	0	112.1	E123 E124 M125 L130 C131 M174 K177	E123-L127 HydrophobicContact CG-CD1 4.13Å; E123-L127 HydrophobicContact CG-CG 4.42Å; E123-L127 WeakPolarHBondContact O-CG 3.38Å; E123-L127 PolarHBondContact O-N 2.71Å; E124-L127 PolarHBondContact O-N 3.34Å; M125-L127 PolarHBondContact O-N 2.67Å; L127-L130 PolarHBondContact O-N 3.12Å; L127-C131 PolarHBondContact O-N 3.15Å; L127-C131 PolarHBondContact O-SG 3.08Å; L127-M174 HydrophobicContact CD2-CE 4.05Å; L127-M174 HydrophobicContact CG-CE 4.39Å; L127-K177 HydrophobicContact CD2-CB 3.89Å
128	S	87.7	Confident	86.8	Confident	64 Å²	64	57.2 Å²	57.2	45%	0.448	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-48.7	175.1	178.7	0	0	0	0	111.3	E124 M125 L130 C131 E132	E124-S128 WeakPolarHBondContact O-CB 3.04Å; E124-S128 PolarHBondContact O-N 3.02Å; M125-S128 PolarHBondContact O-N 2.56Å; S128-L130 VanDerWaalsContact C-N 3.35Å; S128-L130 PolarHBondContact O-N 3.23Å; S128-C131 WeakPolarHBondContact O-CB 3.3Å; S128-C131 PolarHBondContact O-N 2.96Å; S128-C131 VanDerWaalsContact O-N 3.17Å; S128-E132 PolarHBondContact O-N 2.99Å
129	W	89.1	Confident	87	Confident	68 Å²	68	60 Å²	60	26%	0.258	28%	0.278	S	S	.	.	H	α-helix	trans	-59.5	-43.3	175.7	177.8	78.1	0	0	0	112.3	Q106 V107 M125 C126 C131 E132 Q133	Q106-W129 HydrophobicContact CB-CG 4.28Å; V107-W129 HydrophobicContact CG2-CB 4.28Å; V107-W129 HydrophobicContact CG2-CD2 3.81Å; V107-W129 HydrophobicContact CG2-CE3 3.9Å; V107-W129 HydrophobicContact CG2-CG 3.98Å; M125-W129 VanDerWaalsContact O-CB 3.31Å; M125-W129 WeakPolarHBondContact O-CB 3.39Å; M125-W129 PolarHBondContact O-N 2.93Å; C126-W129 PolarHBondContact O-N 3.48Å; W129-C131 VanDerWaalsContact C-N 3.32Å; W129-C131 PolarHBondContact O-N 3.03Å; W129-E132 WeakPolarHBondContact O-CB 3.27Å; W129-E132 PolarHBondContact O-N 3.45Å; W129-Q133 HydrophobicContact CD2-CG 4.18Å; W129-Q133 HydrophobicContact CE3-CG 4.42Å; W129-Q133 HydrophobicContact CH2-CG 4.24Å; W129-Q133 HydrophobicContact CZ2-CG 4Å; W129-Q133 HydrophobicContact CZ3-CG 4.45Å; W129-Q133 WeakPolarHBondContact O-CG 3.25Å; W129-Q133 PolarHBondContact O-N 2.78Å
130	L	89.3	Confident	87	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-38.8	176.3	-74.5	172.7	0	0	0	112.3	C126 L127 S128 E132 Q133 V134 I166 L170 M174 L178	C126-L130 WeakPolarHBondContact O-CB 3.43Å; C126-L130 VanDerWaalsContact O-CG 3.27Å; C126-L130 WeakPolarHBondContact O-CG 3.31Å; C126-L130 PolarHBondContact O-N 3.28Å; L127-L130 PolarHBondContact O-N 3.12Å; S128-L130 VanDerWaalsContact C-N 3.35Å; S128-L130 PolarHBondContact O-N 3.23Å; L130-E132 VanDerWaalsContact C-N 3.33Å; L130-E132 PolarHBondContact O-N 2.95Å; L130-Q133 PolarHBondContact O-N 3.12Å; L130-V134 WeakPolarHBondContact O-CG2 3.42Å; L130-V134 PolarHBondContact O-N 2.88Å; L130-I166 HydrophobicContact CD2-CG2 4.15Å; L130-L170 HydrophobicContact CD1-CD1 3.98Å; L130-L170 HydrophobicContact CD1-CD2 4.01Å; L130-L170 HydrophobicContact CD2-CD1 4.11Å; L130-L170 HydrophobicContact CD2-CD2 3.93Å; L130-L170 HydrophobicContact CD2-CG 4.5Å; L130-M174 HydrophobicContact CD1-CE 4.01Å; L130-L178 HydrophobicContact CB-CD1 3.82Å; L130-L178 HydrophobicContact CB-CD2 4.32Å
131	C	87.9	Confident	87.1	Confident	23 Å²	23	61.8 Å²	61.8	16%	0.155	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-41.1	174.4	-67	0	0	0	0	111.5	L127 S128 W129 Q133 V134 E135	L127-C131 PolarHBondContact O-N 3.15Å; L127-C131 PolarHBondContact O-SG 3.08Å; S128-C131 WeakPolarHBondContact O-CB 3.3Å; S128-C131 PolarHBondContact O-N 2.96Å; S128-C131 VanDerWaalsContact O-N 3.17Å; W129-C131 VanDerWaalsContact C-N 3.32Å; W129-C131 PolarHBondContact O-N 3.03Å; C131-Q133 VanDerWaalsContact C-N 3.31Å; C131-Q133 PolarHBondContact O-N 2.6Å; C131-V134 WeakPolarHBondContact O-CB 3.33Å; C131-V134 PolarHBondContact O-N 3.47Å; C131-E135 PolarHBondContact O-N 2.91Å
132	E	89.2	Confident	87.2	Confident	98 Å²	98	60.7 Å²	60.7	46%	0.458	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-39.2	173.5	-66.8	-176.6	-179.9	0	0	112.3	S128 W129 L130 E135 K136	S128-E132 PolarHBondContact O-N 2.99Å; W129-E132 WeakPolarHBondContact O-CB 3.27Å; W129-E132 PolarHBondContact O-N 3.45Å; L130-E132 VanDerWaalsContact C-N 3.33Å; L130-E132 PolarHBondContact O-N 2.95Å; E132-E135 PolarHBondContact O-N 2.88Å; E132-K136 WeakPolarHBondContact O-CG 3.37Å; E132-K136 PolarHBondContact O-N 3.5Å
133	Q	88.8	Confident	87.4	Confident	41 Å²	41	63.4 Å²	63.4	19%	0.192	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-42.7	175.2	-61	-51.9	-35.7	0	0	111.3	W129 L130 C131 E135 K136 F137 I166	W129-Q133 HydrophobicContact CD2-CG 4.18Å; W129-Q133 HydrophobicContact CE3-CG 4.42Å; W129-Q133 HydrophobicContact CH2-CG 4.24Å; W129-Q133 HydrophobicContact CZ2-CG 4Å; W129-Q133 HydrophobicContact CZ3-CG 4.45Å; W129-Q133 WeakPolarHBondContact O-CG 3.25Å; W129-Q133 PolarHBondContact O-N 2.78Å; L130-Q133 PolarHBondContact O-N 3.12Å; C131-Q133 VanDerWaalsContact C-N 3.31Å; C131-Q133 PolarHBondContact O-N 2.6Å; Q133-E135 VanDerWaalsContact C-N 3.33Å; Q133-E135 PolarHBondContact O-N 3.36Å; Q133-K136 WeakPolarHBondContact O-CB 3.43Å; Q133-K136 PolarHBondContact O-N 3.42Å; Q133-F137 WeakPolarHBondContact O-CD2 3.39Å; Q133-F137 PolarHBondContact O-N 3.41Å; Q133-I166 HydrophobicContact CB-CD1 4.09Å
134	V	88.7	Confident	87.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-55.8	-48.2	174.4	173.1	0	0	0	0	110.6	L130 C131 K136 F137 K138 A162 V163 I166 L178 L182	L130-V134 WeakPolarHBondContact O-CG2 3.42Å; L130-V134 PolarHBondContact O-N 2.88Å; C131-V134 WeakPolarHBondContact O-CB 3.33Å; C131-V134 PolarHBondContact O-N 3.47Å; V134-K136 PolarHBondContact O-N 2.86Å; V134-F137 PolarHBondContact O-N 2.94Å; V134-K138 HydrophobicContact CG1-CD 4.04Å; V134-K138 HydrophobicContact CG1-CG 4.43Å; V134-K138 VanDerWaalsContact O-CG 3.28Å; V134-K138 WeakPolarHBondContact O-CG 3.38Å; V134-K138 PolarHBondContact O-N 3.28Å; V134-A162 HydrophobicContact CG1-CB 3.97Å; V134-V163 HydrophobicContact CG1-CG2 4.11Å; V134-V163 HydrophobicContact CG2-CG2 3.8Å; V134-I166 HydrophobicContact CB-CD1 4.22Å; V134-I166 HydrophobicContact CG2-CD1 3.42Å; V134-I166 VanDerWaalsContact CG2-CD1 3.42Å; V134-L178 HydrophobicContact CG2-CD2 4.32Å; V134-L182 HydrophobicContact CG1-CD1 4.25Å; V134-L182 HydrophobicContact CG2-CD1 4.07Å
135	E	88.6	Confident	87.3	Confident	76 Å²	76	62.4 Å²	62.4	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-40.3	178.2	-69.3	-55.9	139.4	0	0	112.6	C131 E132 Q133 F137 K138 H139	C131-E135 PolarHBondContact O-N 2.91Å; E132-E135 PolarHBondContact O-N 2.88Å; Q133-E135 VanDerWaalsContact C-N 3.33Å; Q133-E135 PolarHBondContact O-N 3.36Å; E135-F137 VanDerWaalsContact C-N 3.34Å; E135-F137 PolarHBondContact O-N 3.4Å; E135-K138 PolarHBondContact O-N 2.84Å; E135-K138 WeakPolarHBondContact OE1-CD 3.28Å; E135-K138 IonicContact OE1-NZ 2.68Å; E135-K138 PolarHBondContact OE1-NZ 3.14Å; E135-K138 IonicContact OE2-NZ 2.74Å; E135-K138 PolarHBondContact OE2-NZ 2.68Å; E135-H139 PolarHBondContact O-CD2 3.39Å; E135-H139 PolarHBondContact O-N 3.47Å
136	K	89.3	Confident	86.9	Confident	101 Å²	101	62.5 Å²	62.5	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-57.7	-45.7	172.3	-74.6	168	-177.8	164.7	0	111.5	E132 Q133 V134 H139 V140	E132-K136 WeakPolarHBondContact O-CG 3.37Å; E132-K136 PolarHBondContact O-N 3.5Å; Q133-K136 WeakPolarHBondContact O-CB 3.43Å; Q133-K136 PolarHBondContact O-N 3.42Å; V134-K136 PolarHBondContact O-N 2.86Å; K136-H139 PolarHBondContact O-N 3.18Å; K136-V140 VanDerWaalsContact O-CG2 3.29Å; K136-V140 WeakPolarHBondContact O-CG2 3.45Å; K136-V140 PolarHBondContact O-N 3.08Å
137	F	86.7	Confident	86.6	Confident	67 Å²	67	62.7 Å²	62.7	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-44.4	176.1	-85	-71.2	0	0	0	112.1	Q133 V134 E135 H139 V140 F141 A162 I166	Q133-F137 WeakPolarHBondContact O-CD2 3.39Å; Q133-F137 PolarHBondContact O-N 3.41Å; V134-F137 PolarHBondContact O-N 2.94Å; E135-F137 VanDerWaalsContact C-N 3.34Å; E135-F137 PolarHBondContact O-N 3.4Å; F137-H139 VanDerWaalsContact C-N 3.33Å; F137-H139 PolarHBondContact O-N 3.11Å; F137-V140 PolarHBondContact O-N 2.79Å; F137-F141 HydrophobicContact CB-CD2 4.36Å; F137-F141 HydrophobicContact CB-CE2 3.79Å; F137-F141 HydrophobicContact CB-CZ 4.19Å; F137-F141 HydrophobicContact CD1-CE1 4.37Å; F137-F141 HydrophobicContact CD1-CE2 4.3Å; F137-F141 AromaticContact CD1-CZ 3.82Å; F137-F141 HydrophobicContact CD1-CZ 3.82Å; F137-F141 HydrophobicContact CG-CE2 4.45Å; F137-F141 HydrophobicContact CG-CZ 4.39Å; F137-F141 WeakPolarHBondContact O-CD2 3.41Å; F137-F141 WeakPolarHBondContact O-CG 3.18Å; F137-F141 PolarHBondContact O-N 2.75Å; F137-A162 HydrophobicContact CB-CB 4.03Å; F137-I166 HydrophobicContact CD2-CD1 3.69Å; F137-I166 HydrophobicContact CD2-CG1 3.74Å; F137-I166 HydrophobicContact CE2-CD1 4.02Å; F137-I166 HydrophobicContact CE2-CG1 3.71Å
138	K	87.1	Confident	86.4	Confident	33 Å²	33	67.9 Å²	67.9	14%	0.143	32%	0.322	C	S	.	.	H	α-helix	trans	-56.3	-47.2	176.4	-67.2	169.7	63.9	-152	0	111.3	V134 E135 F141 Q142 L158 S159 A162	V134-K138 HydrophobicContact CG1-CD 4.04Å; V134-K138 HydrophobicContact CG1-CG 4.43Å; V134-K138 VanDerWaalsContact O-CG 3.28Å; V134-K138 WeakPolarHBondContact O-CG 3.38Å; V134-K138 PolarHBondContact O-N 3.28Å; E135-K138 PolarHBondContact O-N 2.84Å; E135-K138 WeakPolarHBondContact OE1-CD 3.28Å; E135-K138 IonicContact OE1-NZ 2.68Å; E135-K138 PolarHBondContact OE1-NZ 3.14Å; E135-K138 IonicContact OE2-NZ 2.74Å; E135-K138 PolarHBondContact OE2-NZ 2.68Å; K138-F141 PolarHBondContact O-N 3.35Å; K138-Q142 WeakPolarHBondContact O-CG 3.39Å; K138-Q142 PolarHBondContact O-N 2.9Å; K138-L158 HydrophobicContact CB-CD2 4.02Å; K138-L158 HydrophobicContact CB-CG 4.18Å; K138-L158 HydrophobicContact CG-CD2 4.3Å; K138-L158 HydrophobicContact CG-CG 4.01Å; K138-S159 WeakPolarHBondContact CE-OG 3.45Å; K138-A162 HydrophobicContact CG-CB 3.83Å
139	H	87.1	Confident	86.1	Confident	119 Å²	119	74.3 Å²	74.3	55%	0.551	34%	0.337	S	S	*	.	H	α-helix	trans	-62.2	-42.5	176.3	-77.1	-57.3	0	0	0	112.8	E135 K136 F137 Q142 R143	E135-H139 PolarHBondContact O-CD2 3.39Å; E135-H139 PolarHBondContact O-N 3.47Å; K136-H139 PolarHBondContact O-N 3.18Å; F137-H139 VanDerWaalsContact C-N 3.33Å; F137-H139 PolarHBondContact O-N 3.11Å; H139-Q142 PolarHBondContact O-N 2.7Å; H139-R143 VanDerWaalsContact O-CB 3.28Å; H139-R143 WeakPolarHBondContact O-CB 3.38Å; H139-R143 PolarHBondContact O-N 2.7Å
140	V	86.6	Confident	85.7	Confident	41 Å²	41	75.6 Å²	75.6	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-64.2	-44.5	177.8	171.4	0	0	0	0	111.1	K136 F137 Q142 R143 L144 L146	K136-V140 VanDerWaalsContact O-CG2 3.29Å; K136-V140 WeakPolarHBondContact O-CG2 3.45Å; K136-V140 PolarHBondContact O-N 3.08Å; F137-V140 PolarHBondContact O-N 2.79Å; V140-Q142 VanDerWaalsContact C-N 3.31Å; V140-Q142 PolarHBondContact O-N 3.47Å; V140-R143 PolarHBondContact O-N 3.31Å; V140-L144 HydrophobicContact CG1-CD1 3.71Å; V140-L144 HydrophobicContact CG1-CG 4.34Å; V140-L144 WeakPolarHBondContact O-CB 3.41Å; V140-L144 PolarHBondContact O-N 3.01Å; V140-L146 HydrophobicContact CG1-CD1 4.45Å
141	F	86.7	Confident	85.2	Confident	16 Å²	16	77.4 Å²	77.4	7%	0.07	36%	0.362	C	S	.	.	H	α-helix	trans	-61.9	-39.7	178.1	-64.6	-38.8	0	0	0	112.7	F137 K138 N145 L146 I147 L152 L158 Y161 A162 T165	F137-F141 HydrophobicContact CB-CD2 4.36Å; F137-F141 HydrophobicContact CB-CE2 3.79Å; F137-F141 HydrophobicContact CB-CZ 4.19Å; F137-F141 HydrophobicContact CD1-CE1 4.37Å; F137-F141 HydrophobicContact CD1-CE2 4.3Å; F137-F141 AromaticContact CD1-CZ 3.82Å; F137-F141 HydrophobicContact CD1-CZ 3.82Å; F137-F141 HydrophobicContact CG-CE2 4.45Å; F137-F141 HydrophobicContact CG-CZ 4.39Å; F137-F141 WeakPolarHBondContact O-CD2 3.41Å; F137-F141 WeakPolarHBondContact O-CG 3.18Å; F137-F141 PolarHBondContact O-N 2.75Å; K138-F141 PolarHBondContact O-N 3.35Å; F141-N145 WeakPolarHBondContact O-CA 3.43Å; F141-N145 PolarHBondContact O-N 3.26Å; F141-N145 VanDerWaalsContact O-N 3.09Å; F141-L146 HydrophobicContact CD1-CB 4.31Å; F141-L146 HydrophobicContact CD1-CD1 4.28Å; F141-L146 PolarHBondContact O-N 2.68Å; F141-I147 HydrophobicContact CB-CD1 3.54Å; F141-I147 HydrophobicContact CB-CG1 4.1Å; F141-I147 HydrophobicContact CD1-CD1 3.82Å; F141-I147 HydrophobicContact CD1-CG1 4.09Å; F141-I147 HydrophobicContact CD2-CD1 3.58Å; F141-I147 HydrophobicContact CE1-CD1 4.42Å; F141-I147 HydrophobicContact CE2-CD1 4.22Å; F141-I147 HydrophobicContact CG-CD1 3.37Å; F141-I147 HydrophobicContact CG-CG1 4.07Å; F141-L152 HydrophobicContact CB-CD2 4.2Å; F141-L152 WeakPolarHBondContact O-CD2 3.17Å; F141-L158 HydrophobicContact CB-CD1 4.06Å; F141-L158 HydrophobicContact CD2-CD1 4.21Å; F141-Y161 HydrophobicContact CD2-CD1 4.13Å; F141-Y161 HydrophobicContact CE1-CE1 4.11Å; F141-Y161 AromaticContact CE2-CD1 3.71Å; F141-Y161 HydrophobicContact CE2-CD1 3.71Å; F141-Y161 HydrophobicContact CE2-CE1 4.06Å; F141-Y161 AromaticContact CZ-CD1 3.96Å; F141-Y161 HydrophobicContact CZ-CD1 3.96Å; F141-Y161 AromaticContact CZ-CE1 3.84Å; F141-Y161 HydrophobicContact CZ-CE1 3.84Å; F141-A162 HydrophobicContact CD2-CB 4.42Å; F141-A162 HydrophobicContact CE2-CB 3.92Å; F141-T165 HydrophobicContact CZ-CG2 4.01Å
142	Q	86.1	Confident	84.8	Confident	88 Å²	88	77.5 Å²	77.5	41%	0.411	36%	0.36	S	S	.	.	H	α-helix	trans	-66.5	-48.1	174	-72.4	174.4	-27.3	0	0	111.6	K138 H139 V140 N145 L152 L158	K138-Q142 WeakPolarHBondContact O-CG 3.39Å; K138-Q142 PolarHBondContact O-N 2.9Å; H139-Q142 PolarHBondContact O-N 2.7Å; V140-Q142 VanDerWaalsContact C-N 3.31Å; V140-Q142 PolarHBondContact O-N 3.47Å; Q142-N145 PolarHBondContact O-N 3.21Å; Q142-L152 HydrophobicContact CG-CD2 4.29Å; Q142-L158 HydrophobicContact CG-CD2 3.82Å
143	R	87.1	Confident	84.2	Confident	187 Å²	187	77.5 Å²	77.5	71%	0.706	37%	0.37	S	S	*	.	H	α-helix	trans	-64.9	-43.2	-176.7	-173.1	178.2	71.1	172.7	2.4	112.5	H139 V140	H139-R143 VanDerWaalsContact O-CB 3.28Å; H139-R143 WeakPolarHBondContact O-CB 3.38Å; H139-R143 PolarHBondContact O-N 2.7Å; V140-R143 PolarHBondContact O-N 3.31Å
144	L	86	Confident	83.8	Confident	69 Å²	69	77.8 Å²	77.8	36%	0.361	38%	0.377	S	S	.	.	H	α-helix	trans	-91.9	-1.3	-175.9	-64.8	-179.7	0	0	0	113.1	W35 V140 L146	W35-L144 HydrophobicContact CH2-CD1 3.76Å; W35-L144 HydrophobicContact CZ2-CD1 4.49Å; W35-L144 HydrophobicContact CZ3-CD1 4.22Å; V140-L144 HydrophobicContact CG1-CD1 3.71Å; V140-L144 HydrophobicContact CG1-CG 4.34Å; V140-L144 WeakPolarHBondContact O-CB 3.41Å; V140-L144 PolarHBondContact O-N 3.01Å; L144-L146 HydrophobicContact CB-CD1 3.8Å; L144-L146 HydrophobicContact CB-CD2 4.06Å; L144-L146 HydrophobicContact CB-CG 3.52Å; L144-L146 HydrophobicContact CD1-CD1 3.81Å; L144-L146 HydrophobicContact CD1-CG 4.4Å; L144-L146 HydrophobicContact CG-CD1 4.45Å; L144-L146 PolarHBondContact O-N 3.17Å; L144-L146 VanDerWaalsContact O-N 3.13Å
145	N	82.4	Confident	83.4	Confident	120 Å²	120	80.2 Å²	80.2	64%	0.642	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	39.3	-175.6	-73.4	-53.1	0	0	0	113.4	F141 Q142 I147 L152	F141-N145 WeakPolarHBondContact O-CA 3.43Å; F141-N145 PolarHBondContact O-N 3.26Å; F141-N145 VanDerWaalsContact O-N 3.09Å; Q142-N145 PolarHBondContact O-N 3.21Å; N145-I147 PolarHBondContact O-N 3.5Å; N145-L152 WeakPolarHBondContact OD1-CD1 3.28Å
146	L	76.5	Confident	83.1	Confident	66 Å²	66	79.2 Å²	79.2	35%	0.346	41%	0.412	S	S	.	.			trans	-74	-8.3	-173.4	-66.6	172.2	0	0	0	113.7	V140 F141 L144	V140-L146 HydrophobicContact CG1-CD1 4.45Å; F141-L146 HydrophobicContact CD1-CB 4.31Å; F141-L146 HydrophobicContact CD1-CD1 4.28Å; F141-L146 PolarHBondContact O-N 2.68Å; L144-L146 HydrophobicContact CB-CD1 3.8Å; L144-L146 HydrophobicContact CB-CD2 4.06Å; L144-L146 HydrophobicContact CB-CG 3.52Å; L144-L146 HydrophobicContact CD1-CD1 3.81Å; L144-L146 HydrophobicContact CD1-CG 4.4Å; L144-L146 HydrophobicContact CG-CD1 4.45Å; L144-L146 PolarHBondContact O-N 3.17Å; L144-L146 VanDerWaalsContact O-N 3.13Å
147	I	81	Confident	82.8	Confident	17 Å²	17	76.9 Å²	76.9	9%	0.087	41%	0.408	C	S	.	.	S	Bend	trans	-126.4	151.9	-174.5	-44.2	171.4	0	0	0	109.5	F141 N145 R149 I151 L152 L158 Y161	F141-I147 HydrophobicContact CB-CD1 3.54Å; F141-I147 HydrophobicContact CB-CG1 4.1Å; F141-I147 HydrophobicContact CD1-CD1 3.82Å; F141-I147 HydrophobicContact CD1-CG1 4.09Å; F141-I147 HydrophobicContact CD2-CD1 3.58Å; F141-I147 HydrophobicContact CE1-CD1 4.42Å; F141-I147 HydrophobicContact CE2-CD1 4.22Å; F141-I147 HydrophobicContact CG-CD1 3.37Å; F141-I147 HydrophobicContact CG-CG1 4.07Å; N145-I147 PolarHBondContact O-N 3.5Å; I147-R149 PolarHBondContact O-N 2.93Å; I147-I151 HydrophobicContact CD1-CG2 4.38Å; I147-I151 HydrophobicContact CG2-CB 3.62Å; I147-I151 HydrophobicContact CG2-CD1 3.42Å; I147-I151 VanDerWaalsContact CG2-CD1 3.42Å; I147-I151 HydrophobicContact CG2-CG1 4.06Å; I147-I151 HydrophobicContact CG2-CG2 3.78Å; I147-L152 HydrophobicContact CB-CD2 4.18Å; I147-L152 HydrophobicContact CB-CG 4.33Å; I147-L152 HydrophobicContact CD1-CD2 4.47Å; I147-L152 VanDerWaalsContact O-CD1 3.28Å; I147-L152 WeakPolarHBondContact O-CD1 3.5Å; I147-L158 HydrophobicContact CD1-CD1 4.12Å; I147-Y161 HydrophobicContact CD1-CD1 3.18Å; I147-Y161 HydrophobicContact CD1-CD2 4.44Å; I147-Y161 HydrophobicContact CD1-CE1 3.28Å; I147-Y161 HydrophobicContact CD1-CG 3.79Å; I147-Y161 HydrophobicContact CG1-CD1 4.12Å; I147-Y161 HydrophobicContact CG1-CE1 3.72Å; I147-Y161 HydrophobicContact CG2-CD2 4.44Å; I147-Y161 HydrophobicContact CG2-CE2 4.25Å
148	H	83.5	Confident	82.7	Confident	128 Å²	128	73.8 Å²	73.8	59%	0.593	40%	0.395	S	S	*	.			trans	-50.7	138.7	173.2	-167.9	-98.7	0	0	0	112.1	T150 I151 L152	H148-T150 PolarHBondContact ND1-N 3.24Å; H148-T150 PolarHBondContact ND1-OG1 3.43Å; H148-T150 PolarHBondContact O-N 2.92Å; H148-I151 PolarHBondContact O-N 3Å; H148-L152 PolarHBondContact O-N 2.93Å
149	R	80.5	Confident	82.7	Confident	200 Å²	200	73.4 Å²	73.4	76%	0.755	40%	0.396	S	S	*	.	H	α-helix	trans	-52.3	-33.7	-174.7	-171.8	174.9	178.5	178.3	0.6	113.7	I147 I151 L152 C153	I147-R149 PolarHBondContact O-N 2.93Å; R149-I151 VanDerWaalsContact C-N 3.28Å; R149-I151 PolarHBondContact O-N 2.94Å; R149-L152 PolarHBondContact O-N 3.49Å; R149-C153 WeakPolarHBondContact O-CB 3.29Å; R149-C153 PolarHBondContact O-N 3.2Å; R149-C153 PolarHBondContact O-SG 3.42Å
150	T	79.8	Confident	82.6	Confident	94 Å²	94	70.6 Å²	70.6	58%	0.577	39%	0.39	S	S	*	.	H	α-helix	trans	-62.9	-33.4	177.6	56.3	0	0	0	0	113.2	H148 S154	H148-T150 PolarHBondContact ND1-N 3.24Å; H148-T150 PolarHBondContact ND1-OG1 3.43Å; H148-T150 PolarHBondContact O-N 2.92Å; T150-S154 WeakPolarHBondContact O-CB 3.35Å
151	I	79.4	Confident	82.5	Confident	42 Å²	42	72.7 Å²	72.7	22%	0.215	39%	0.394	C	S	.	.	H	α-helix	trans	-78.3	-41.5	177	-62.4	168.2	0	0	0	109.3	I147 H148 R149 C153 S154 Y161	I147-I151 HydrophobicContact CD1-CG2 4.38Å; I147-I151 HydrophobicContact CG2-CB 3.62Å; I147-I151 HydrophobicContact CG2-CD1 3.42Å; I147-I151 VanDerWaalsContact CG2-CD1 3.42Å; I147-I151 HydrophobicContact CG2-CG1 4.06Å; I147-I151 HydrophobicContact CG2-CG2 3.78Å; H148-I151 PolarHBondContact O-N 3Å; R149-I151 VanDerWaalsContact C-N 3.28Å; R149-I151 PolarHBondContact O-N 2.94Å; I151-C153 VanDerWaalsContact C-N 3.32Å; I151-C153 PolarHBondContact O-N 3.43Å; I151-S154 PolarHBondContact O-N 3.17Å; I151-S154 VanDerWaalsContact O-O 3.1Å; I151-Y161 HydrophobicContact CD1-CD2 4.34Å; I151-Y161 HydrophobicContact CG2-CG 4.44Å
152	L	79.8	Confident	82.6	Confident	24 Å²	24	72 Å²	72	13%	0.126	39%	0.391	C	S	.	.	H	α-helix	trans	-62.9	-36.5	178.2	-64.8	178.3	0	0	0	113.1	F141 Q142 N145 I147 H148 R149 L158	F141-L152 HydrophobicContact CB-CD2 4.2Å; F141-L152 WeakPolarHBondContact O-CD2 3.17Å; Q142-L152 HydrophobicContact CG-CD2 4.29Å; N145-L152 WeakPolarHBondContact OD1-CD1 3.28Å; I147-L152 HydrophobicContact CB-CD2 4.18Å; I147-L152 HydrophobicContact CB-CG 4.33Å; I147-L152 HydrophobicContact CD1-CD2 4.47Å; I147-L152 VanDerWaalsContact O-CD1 3.28Å; I147-L152 WeakPolarHBondContact O-CD1 3.5Å; H148-L152 PolarHBondContact O-N 2.93Å; R149-L152 PolarHBondContact O-N 3.49Å; L152-L158 HydrophobicContact CD2-CD1 4.02Å
153	C	76.6	Confident	82.6	Confident	98 Å²	98	67.9 Å²	67.9	66%	0.662	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-12.4	-179.8	-65.8	0	0	0	0	114.1	R149 I151	R149-C153 WeakPolarHBondContact O-CB 3.29Å; R149-C153 PolarHBondContact O-N 3.2Å; R149-C153 PolarHBondContact O-SG 3.42Å; I151-C153 VanDerWaalsContact C-N 3.32Å; I151-C153 PolarHBondContact O-N 3.43Å
154	S	81.4	Confident	82.5	Confident	48 Å²	48	60.8 Å²	60.8	34%	0.336	36%	0.357	S	S	.	.			trans	-108.9	108.2	-180	174.5	0	0	0	0	110.1	T150 I151 G156 S157 L158	T150-S154 WeakPolarHBondContact O-CB 3.35Å; I151-S154 PolarHBondContact O-N 3.17Å; I151-S154 VanDerWaalsContact O-O 3.1Å; S154-G156 VanDerWaalsContact C-N 3.29Å; S154-G156 PolarHBondContact O-N 3.31Å; S154-S157 WeakPolarHBondContact CB-OG 3.45Å; S154-S157 PolarHBondContact O-N 3.4Å; S154-S157 VanDerWaalsContact O-N 3.08Å; S154-S157 PolarHBondContact OG-N 2.87Å; S154-S157 PolarHBondContact OG-OG 2.91Å; S154-L158 WeakPolarHBondContact O-CB 3.04Å; S154-L158 PolarHBondContact O-N 3.06Å
155	G	79.2	Confident	82.5	Confident	51 Å²	51	59.3 Å²	59.3	53%	0.526	35%	0.351	S	S	.	.	H	α-helix	trans	-54.2	-42.2	-178	0	0	0	0	0	113.6	L158 S159	G155-L158 PolarHBondContact O-N 3.43Å; G155-S159 PolarHBondContact O-N 3.01Å; G155-S159 PolarHBondContact O-OG 3.18Å
156	G	82.7	Confident	82.7	Confident	54 Å²	54	54.1 Å²	54.1	56%	0.557	32%	0.323	S	S	*	.	H	α-helix	trans	-67.1	-40.1	177	0	0	0	0	0	113.5	S154 S159 S160	S154-G156 VanDerWaalsContact C-N 3.29Å; S154-G156 PolarHBondContact O-N 3.31Å; G156-S159 PolarHBondContact O-N 3.35Å; G156-S160 WeakPolarHBondContact O-CB 3.28Å; G156-S160 PolarHBondContact O-N 3.17Å
157	S	82.1	Confident	83.1	Confident	52 Å²	52	51.7 Å²	51.7	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-67.6	-39	177.6	-55.8	0	0	0	0	111.5	S154 S160 Y161	S154-S157 WeakPolarHBondContact CB-OG 3.45Å; S154-S157 PolarHBondContact O-N 3.4Å; S154-S157 VanDerWaalsContact O-N 3.08Å; S154-S157 PolarHBondContact OG-N 2.87Å; S154-S157 PolarHBondContact OG-OG 2.91Å; S157-S160 PolarHBondContact O-N 2.9Å; S157-Y161 WeakPolarHBondContact O-CB 3.33Å; S157-Y161 PolarHBondContact O-N 2.89Å
158	L	85.6	Confident	83.1	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-64.4	-45.5	177.5	-173.7	62.5	0	0	0	111.5	K138 F141 Q142 I147 L152 S154 G155 Y161 A162	K138-L158 HydrophobicContact CB-CD2 4.02Å; K138-L158 HydrophobicContact CB-CG 4.18Å; K138-L158 HydrophobicContact CG-CD2 4.3Å; K138-L158 HydrophobicContact CG-CG 4.01Å; F141-L158 HydrophobicContact CB-CD1 4.06Å; F141-L158 HydrophobicContact CD2-CD1 4.21Å; Q142-L158 HydrophobicContact CG-CD2 3.82Å; I147-L158 HydrophobicContact CD1-CD1 4.12Å; L152-L158 HydrophobicContact CD2-CD1 4.02Å; S154-L158 WeakPolarHBondContact O-CB 3.04Å; S154-L158 PolarHBondContact O-N 3.06Å; G155-L158 PolarHBondContact O-N 3.43Å; L158-Y161 PolarHBondContact O-N 3.37Å; L158-A162 WeakPolarHBondContact O-CB 3.4Å; L158-A162 PolarHBondContact O-N 3.41Å
159	S	85.8	Confident	82.9	Confident	25 Å²	25	57.3 Å²	57.3	18%	0.175	34%	0.336	C	S	.	.	H	α-helix	trans	-62.8	-43.7	175.1	-62.7	0	0	0	0	111.9	K138 G155 G156 Y161 A162 V163	K138-S159 WeakPolarHBondContact CE-OG 3.45Å; G155-S159 PolarHBondContact O-N 3.01Å; G155-S159 PolarHBondContact O-OG 3.18Å; G156-S159 PolarHBondContact O-N 3.35Å; S159-Y161 VanDerWaalsContact C-N 3.31Å; S159-Y161 PolarHBondContact O-N 3.39Å; S159-A162 PolarHBondContact O-N 3.15Å; S159-V163 WeakPolarHBondContact O-CG2 3.47Å; S159-V163 PolarHBondContact O-N 2.99Å
160	S	85.4	Confident	83	Confident	61 Å²	61	49.9 Å²	49.9	43%	0.427	31%	0.311	S	S	.	.	H	α-helix	trans	-61.8	-40	176.4	-176.9	0	0	0	0	112.2	G156 S157 G164	G156-S160 WeakPolarHBondContact O-CB 3.28Å; G156-S160 PolarHBondContact O-N 3.17Å; S157-S160 PolarHBondContact O-N 2.9Å; S160-G164 PolarHBondContact O-N 3.36Å
161	Y	85.8	Confident	83.1	Confident	85 Å²	85	50.5 Å²	50.5	33%	0.333	31%	0.311	S	S	.	.	H	α-helix	trans	-65.8	-46.1	176.1	-169.6	-86	0	0	0	111.8	F141 I147 I151 S157 L158 S159 V163 G164 T165	F141-Y161 HydrophobicContact CD2-CD1 4.13Å; F141-Y161 HydrophobicContact CE1-CE1 4.11Å; F141-Y161 AromaticContact CE2-CD1 3.71Å; F141-Y161 HydrophobicContact CE2-CD1 3.71Å; F141-Y161 HydrophobicContact CE2-CE1 4.06Å; F141-Y161 AromaticContact CZ-CD1 3.96Å; F141-Y161 HydrophobicContact CZ-CD1 3.96Å; F141-Y161 AromaticContact CZ-CE1 3.84Å; F141-Y161 HydrophobicContact CZ-CE1 3.84Å; I147-Y161 HydrophobicContact CD1-CD1 3.18Å; I147-Y161 HydrophobicContact CD1-CD2 4.44Å; I147-Y161 HydrophobicContact CD1-CE1 3.28Å; I147-Y161 HydrophobicContact CD1-CG 3.79Å; I147-Y161 HydrophobicContact CG1-CD1 4.12Å; I147-Y161 HydrophobicContact CG1-CE1 3.72Å; I147-Y161 HydrophobicContact CG2-CD2 4.44Å; I147-Y161 HydrophobicContact CG2-CE2 4.25Å; I151-Y161 HydrophobicContact CD1-CD2 4.34Å; I151-Y161 HydrophobicContact CG2-CG 4.44Å; S157-Y161 WeakPolarHBondContact O-CB 3.33Å; S157-Y161 PolarHBondContact O-N 2.89Å; L158-Y161 PolarHBondContact O-N 3.37Å; S159-Y161 VanDerWaalsContact C-N 3.31Å; S159-Y161 PolarHBondContact O-N 3.39Å; Y161-V163 PolarHBondContact O-N 2.86Å; Y161-G164 PolarHBondContact O-N 3.15Å; Y161-T165 HydrophobicContact CD1-CG2 4.19Å; Y161-T165 HydrophobicContact CE1-CG2 3.89Å; Y161-T165 PolarHBondContact O-N 2.97Å
162	A	87.4	Confident	83.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-42.6	178.3	0	0	0	0	0	112.7	V134 F137 K138 F141 L158 S159 T165 I166	V134-A162 HydrophobicContact CG1-CB 3.97Å; F137-A162 HydrophobicContact CB-CB 4.03Å; K138-A162 HydrophobicContact CG-CB 3.83Å; F141-A162 HydrophobicContact CD2-CB 4.42Å; F141-A162 HydrophobicContact CE2-CB 3.92Å; L158-A162 WeakPolarHBondContact O-CB 3.4Å; L158-A162 PolarHBondContact O-N 3.41Å; S159-A162 PolarHBondContact O-N 3.15Å; A162-T165 PolarHBondContact O-N 2.99Å; A162-T165 PolarHBondContact O-OG1 2.92Å; A162-I166 WeakPolarHBondContact O-CG1 3.38Å; A162-I166 PolarHBondContact O-N 3.39Å
163	V	87.3	Confident	83.2	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-62.1	-46.1	172.9	171	0	0	0	0	110.6	V134 S159 Y161 T165 I166 C167 L178 K179 L182 I184	V134-V163 HydrophobicContact CG1-CG2 4.11Å; V134-V163 HydrophobicContact CG2-CG2 3.8Å; S159-V163 WeakPolarHBondContact O-CG2 3.47Å; S159-V163 PolarHBondContact O-N 2.99Å; Y161-V163 PolarHBondContact O-N 2.86Å; V163-T165 PolarHBondContact O-N 3.23Å; V163-I166 PolarHBondContact O-N 3.42Å; V163-C167 VanDerWaalsContact CG1-SG 3.59Å; V163-C167 PolarHBondContact O-N 3.21Å; V163-C167 PolarHBondContact O-SG 3.48Å; V163-L178 HydrophobicContact CG1-CD2 4.37Å; V163-K179 HydrophobicContact CG1-CG 3.94Å; V163-L182 HydrophobicContact CG2-CD1 3.36Å; V163-I184 HydrophobicContact CB-CD1 3.99Å; V163-I184 HydrophobicContact CG1-CD1 4.42Å; V163-I184 HydrophobicContact CG2-CD1 3.51Å
164	G	85.6	Confident	83.5	Confident	38 Å²	38	50.8 Å²	50.8	39%	0.392	31%	0.313	S	S	.	.	H	α-helix	trans	-54.8	-35.6	176.5	0	0	0	0	0	113.6	S160 Y161	S160-G164 PolarHBondContact O-N 3.36Å; Y161-G164 PolarHBondContact O-N 3.15Å
165	T	85.6	Confident	83.6	Confident	38 Å²	38	50.8 Å²	50.8	23%	0.233	31%	0.308	C	S	.	.	H	α-helix	trans	-72.7	-29.1	175.5	52.7	0	0	0	0	114.2	F141 Y161 A162 V163	F141-T165 HydrophobicContact CZ-CG2 4.01Å; Y161-T165 HydrophobicContact CD1-CG2 4.19Å; Y161-T165 HydrophobicContact CE1-CG2 3.89Å; Y161-T165 PolarHBondContact O-N 2.97Å; A162-T165 PolarHBondContact O-N 2.99Å; A162-T165 PolarHBondContact O-OG1 2.92Å; V163-T165 PolarHBondContact O-N 3.23Å
166	I	86.6	Confident	83.8	Confident	12 Å²	12	54.3 Å²	54.3	6%	0.062	31%	0.31	C	S	.	.	H	α-helix	trans	-83.6	-32.9	178.8	-63	174.3	0	0	0	111	L130 Q133 V134 F137 A162 V163 D168 Y169 L170	L130-I166 HydrophobicContact CD2-CG2 4.15Å; Q133-I166 HydrophobicContact CB-CD1 4.09Å; V134-I166 HydrophobicContact CB-CD1 4.22Å; V134-I166 HydrophobicContact CG2-CD1 3.42Å; V134-I166 VanDerWaalsContact CG2-CD1 3.42Å; F137-I166 HydrophobicContact CD2-CD1 3.69Å; F137-I166 HydrophobicContact CD2-CG1 3.74Å; F137-I166 HydrophobicContact CE2-CD1 4.02Å; F137-I166 HydrophobicContact CE2-CG1 3.71Å; A162-I166 WeakPolarHBondContact O-CG1 3.38Å; A162-I166 PolarHBondContact O-N 3.39Å; V163-I166 PolarHBondContact O-N 3.42Å; I166-D168 PolarHBondContact O-N 3.21Å; I166-D168 VanDerWaalsContact O-N 3.12Å; I166-Y169 PolarHBondContact O-N 2.94Å; I166-L170 HydrophobicContact CG2-CD1 3.72Å; I166-L170 HydrophobicContact CG2-CG 4.1Å
167	C	84.2	Confident	83.9	Confident	15 Å²	15	54.9 Å²	54.9	10%	0.101	30%	0.297	C	S	.	.	H	α-helix	trans	-55.7	-29.5	178.9	-67.7	0	0	0	0	113.2	V163 Y169 L170 E175	V163-C167 VanDerWaalsContact CG1-SG 3.59Å; V163-C167 PolarHBondContact O-N 3.21Å; V163-C167 PolarHBondContact O-SG 3.48Å; C167-Y169 PolarHBondContact O-N 3.19Å; C167-L170 PolarHBondContact O-N 2.9Å; C167-E175 HydrophobicContact CB-CG 4.26Å; C167-E175 VanDerWaalsContact SG-CG 3.52Å
168	D	81.5	Confident	84	Confident	111 Å²	111	52.4 Å²	52.4	59%	0.594	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.3	175.1	-77	-14.4	0	0	0	114	I166	I166-D168 PolarHBondContact O-N 3.21Å; I166-D168 VanDerWaalsContact O-N 3.12Å
169	Y	79.3	Confident	84	Confident	152 Å²	152	53.7 Å²	53.7	60%	0.596	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	-3.4	179.5	-57.6	-86.5	0	0	0	113.6	R32 I166 C167	R32-Y169 VanDerWaalsContact NH2-CE1 3.32Å; I166-Y169 PolarHBondContact O-N 2.94Å; C167-Y169 PolarHBondContact O-N 3.19Å
170	L	82.7	Confident	83.8	Confident	43 Å²	43	56.2 Å²	56.2	23%	0.225	31%	0.308	C	S	.	.	S	Bend	trans	-106.1	152.5	-176.3	-70.6	176.2	0	0	0	111.4	L130 I166 C167 M174 L178	L130-L170 HydrophobicContact CD1-CD1 3.98Å; L130-L170 HydrophobicContact CD1-CD2 4.01Å; L130-L170 HydrophobicContact CD2-CD1 4.11Å; L130-L170 HydrophobicContact CD2-CD2 3.93Å; L130-L170 HydrophobicContact CD2-CG 4.5Å; I166-L170 HydrophobicContact CG2-CD1 3.72Å; I166-L170 HydrophobicContact CG2-CG 4.1Å; C167-L170 PolarHBondContact O-N 2.9Å; L170-M174 HydrophobicContact CB-CB 4.49Å; L170-M174 HydrophobicContact CD2-CB 4.36Å; L170-L178 HydrophobicContact CD1-CD2 3.93Å
171	D	81.6	Confident	83.6	Confident	108 Å²	108	59 Å²	59	58%	0.578	31%	0.314	S	S	*	.			trans	-69.2	149	163.5	-175.8	23.4	0	0	0	110.4	C173 M174 E175	D171-C173 PolarHBondContact O-N 3.32Å; D171-C173 VanDerWaalsContact O-N 3.15Å; D171-M174 PolarHBondContact O-N 3.43Å; D171-E175 PolarHBondContact O-N 2.98Å
172	T	80.9	Confident	83.4	Confident	89 Å²	89	57.6 Å²	57.6	55%	0.546	31%	0.312	S	S	.	.	H	α-helix	trans	-52.4	-36.6	-178.6	55.2	0	0	0	0	113	E175 Q176	T172-E175 PolarHBondContact O-N 3.41Å; T172-Q176 WeakPolarHBondContact O-CG 3.37Å; T172-Q176 PolarHBondContact O-N 3.38Å; T172-Q176 VanDerWaalsContact O-N 3.09Å
173	C	81	Confident	82.9	Confident	58 Å²	58	60.8 Å²	60.8	39%	0.392	35%	0.345	S	S	.	.	H	α-helix	trans	-63.4	-45	176.1	-178.2	0	0	0	0	111.9	D171 Q176 K177	D171-C173 PolarHBondContact O-N 3.32Å; D171-C173 VanDerWaalsContact O-N 3.15Å; C173-Q176 PolarHBondContact O-N 3.06Å; C173-K177 WeakPolarHBondContact O-CG 3.28Å; C173-K177 PolarHBondContact O-N 2.92Å
174	M	82	Confident	82.1	Confident	23 Å²	23	62.1 Å²	62.1	11%	0.113	35%	0.352	C	S	.	.	H	α-helix	trans	-73.3	-33.5	178.8	-70	-57.7	-64.8	0	0	112.1	Y121 C126 L127 L130 L170 D171 K177 L178	Y121-M174 WeakPolarHBondContact OH-CE 3.46Å; Y121-M174 PolarHBondContact OH-SD 2.89Å; C126-M174 HydrophobicContact CB-CE 4.09Å; C126-M174 VanDerWaalsContact SG-CE 3.56Å; L127-M174 HydrophobicContact CD2-CE 4.05Å; L127-M174 HydrophobicContact CG-CE 4.39Å; L130-M174 HydrophobicContact CD1-CE 4.01Å; L170-M174 HydrophobicContact CB-CB 4.49Å; L170-M174 HydrophobicContact CD2-CB 4.36Å; D171-M174 PolarHBondContact O-N 3.43Å; M174-K177 PolarHBondContact O-N 3.33Å; M174-K177 HydrophobicContact SD-CD 4.07Å; M174-L178 WeakPolarHBondContact O-CB 3.38Å; M174-L178 PolarHBondContact O-N 3.18Å
175	E	83.5	Confident	81	Confident	48 Å²	48	64.4 Å²	64.4	22%	0.224	37%	0.367	C	S	.	.	H	α-helix	trans	-58.9	-47.5	172	165.6	175.2	-172.9	0	0	111.6	C167 D171 T172 K177 L178 K179	C167-E175 HydrophobicContact CB-CG 4.26Å; C167-E175 VanDerWaalsContact SG-CG 3.52Å; D171-E175 PolarHBondContact O-N 2.98Å; T172-E175 PolarHBondContact O-N 3.41Å; E175-K177 VanDerWaalsContact C-N 3.33Å; E175-K177 PolarHBondContact O-N 3.43Å; E175-L178 PolarHBondContact O-N 3.21Å; E175-K179 HydrophobicContact CG-CD 4.01Å; E175-K179 WeakPolarHBondContact O-CB 3.42Å; E175-K179 WeakPolarHBondContact O-CG 3.28Å; E175-K179 PolarHBondContact O-N 2.98Å; E175-K179 VanDerWaalsContact OE1-CE 3.25Å; E175-K179 WeakPolarHBondContact OE1-CE 3.22Å; E175-K179 IonicContact OE1-NZ 2.6Å; E175-K179 PolarHBondContact OE1-NZ 3.34Å
176	Q	83	Confident	79.5	Confident	124 Å²	124	65.6 Å²	65.6	58%	0.579	38%	0.377	S	S	*	.	H	α-helix	trans	-62	-43.4	179	-73.1	178.3	2.1	0	0	111.4	T172 C173 K179 A180	T172-Q176 WeakPolarHBondContact O-CG 3.37Å; T172-Q176 PolarHBondContact O-N 3.38Å; T172-Q176 VanDerWaalsContact O-N 3.09Å; C173-Q176 PolarHBondContact O-N 3.06Å; Q176-K179 PolarHBondContact O-N 3.13Å; Q176-A180 VanDerWaalsContact O-CB 3.28Å; Q176-A180 WeakPolarHBondContact O-CB 3.32Å; Q176-A180 PolarHBondContact O-N 3.5Å
177	K	84.3	Confident	77.9	Confident	67 Å²	67	71.1 Å²	71.1	29%	0.291	41%	0.412	S	S	.	.	H	α-helix	trans	-63.3	-43.4	177.1	-70.3	168	169.4	-169.1	0	112.1	E123 L127 C173 M174 E175 A180 H181	E123-K177 WeakPolarHBondContact OE1-CD 3.4Å; E123-K177 WeakPolarHBondContact OE1-CE 3.49Å; E123-K177 IonicContact OE1-NZ 2.74Å; E123-K177 PolarHBondContact OE1-NZ 3.02Å; E123-K177 IonicContact OE2-NZ 2.73Å; E123-K177 PolarHBondContact OE2-NZ 3.36Å; L127-K177 HydrophobicContact CD2-CB 3.89Å; C173-K177 WeakPolarHBondContact O-CG 3.28Å; C173-K177 PolarHBondContact O-N 2.92Å; M174-K177 PolarHBondContact O-N 3.33Å; M174-K177 HydrophobicContact SD-CD 4.07Å; E175-K177 VanDerWaalsContact C-N 3.33Å; E175-K177 PolarHBondContact O-N 3.43Å; K177-A180 PolarHBondContact O-N 3.28Å; K177-H181 VanDerWaalsContact O-CB 3.28Å; K177-H181 WeakPolarHBondContact O-CB 3.4Å; K177-H181 PolarHBondContact O-N 3.42Å
178	L	85.6	Confident	75.7	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-64.8	-44.1	177.1	-177.3	62.7	0	0	0	111.9	L130 V134 V163 L170 M174 E175 H181 L182	L130-L178 HydrophobicContact CB-CD1 3.82Å; L130-L178 HydrophobicContact CB-CD2 4.32Å; V134-L178 HydrophobicContact CG2-CD2 4.32Å; V163-L178 HydrophobicContact CG1-CD2 4.37Å; L170-L178 HydrophobicContact CD1-CD2 3.93Å; M174-L178 WeakPolarHBondContact O-CB 3.38Å; M174-L178 PolarHBondContact O-N 3.18Å; E175-L178 PolarHBondContact O-N 3.21Å; L178-H181 PolarHBondContact O-N 3.09Å; L178-L182 HydrophobicContact CD1-CD1 3.86Å; L178-L182 HydrophobicContact CD1-CG 4.44Å; L178-L182 HydrophobicContact CG-CD1 4.05Å; L178-L182 WeakPolarHBondContact O-CB 3.46Å; L178-L182 PolarHBondContact O-N 3.47Å
179	K	84.3	Confident	73.8	Confident	28 Å²	28	72.6 Å²	72.6	12%	0.122	44%	0.435	C	S	.	.	H	α-helix	trans	-62.3	-44	176	-77.2	176	172.1	176	0	111.7	V163 E175 Q176 L182 G183 I184	V163-K179 HydrophobicContact CG1-CG 3.94Å; E175-K179 HydrophobicContact CG-CD 4.01Å; E175-K179 WeakPolarHBondContact O-CB 3.42Å; E175-K179 WeakPolarHBondContact O-CG 3.28Å; E175-K179 PolarHBondContact O-N 2.98Å; E175-K179 VanDerWaalsContact OE1-CE 3.25Å; E175-K179 WeakPolarHBondContact OE1-CE 3.22Å; E175-K179 IonicContact OE1-NZ 2.6Å; E175-K179 PolarHBondContact OE1-NZ 3.34Å; Q176-K179 PolarHBondContact O-N 3.13Å; K179-L182 PolarHBondContact O-N 3.41Å; K179-G183 PolarHBondContact O-N 2.88Å; K179-G183 VanDerWaalsContact O-N 3.15Å; K179-I184 PolarHBondContact O-N 3.48Å
180	A	83.3	Confident	71.5	Confident	78 Å²	78	70 Å²	70	65%	0.645	43%	0.431	S	S	*	.	H	α-helix	trans	-61.8	-45.3	175.8	0	0	0	0	0	111.4	Q176 K177 L182 G183	Q176-A180 VanDerWaalsContact O-CB 3.28Å; Q176-A180 WeakPolarHBondContact O-CB 3.32Å; Q176-A180 PolarHBondContact O-N 3.5Å; K177-A180 PolarHBondContact O-N 3.28Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 3.05Å; A180-G183 PolarHBondContact O-N 2.86Å; A180-G183 VanDerWaalsContact O-N 3.15Å
181	H	81.5	Confident	69.2	Low	121 Å²	121	75.7 Å²	75.7	56%	0.56	46%	0.462	S	S	*	.	H	α-helix	trans	-63.2	-34.5	179.2	-166.6	-78.5	0	0	0	112.8	K177 L178	K177-H181 VanDerWaalsContact O-CB 3.28Å; K177-H181 WeakPolarHBondContact O-CB 3.4Å; K177-H181 PolarHBondContact O-N 3.42Å; L178-H181 PolarHBondContact O-N 3.09Å
182	L	79.8	Confident	66.9	Low	54 Å²	54	72.2 Å²	72.2	28%	0.283	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	1.5	178.2	-69.6	167.6	0	0	0	113.8	V134 V163 L178 K179 A180 I184	V134-L182 HydrophobicContact CG1-CD1 4.25Å; V134-L182 HydrophobicContact CG2-CD1 4.07Å; V163-L182 HydrophobicContact CG2-CD1 3.36Å; L178-L182 HydrophobicContact CD1-CD1 3.86Å; L178-L182 HydrophobicContact CD1-CG 4.44Å; L178-L182 HydrophobicContact CG-CD1 4.05Å; L178-L182 WeakPolarHBondContact O-CB 3.46Å; L178-L182 PolarHBondContact O-N 3.47Å; K179-L182 PolarHBondContact O-N 3.41Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 3.05Å; L182-I184 HydrophobicContact CB-CD1 3.77Å; L182-I184 HydrophobicContact CB-CG1 3.94Å; L182-I184 HydrophobicContact CD1-CD1 4.13Å; L182-I184 PolarHBondContact O-N 3.39Å
183	G	77.5	Confident	64.6	Low	68 Å²	68	73.8 Å²	73.8	70%	0.701	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	20.7	-176.8	0	0	0	0	0	113.7	K179 A180 A185	K179-G183 PolarHBondContact O-N 2.88Å; K179-G183 VanDerWaalsContact O-N 3.15Å; A180-G183 PolarHBondContact O-N 2.86Å; A180-G183 VanDerWaalsContact O-N 3.15Å; G183-A185 PolarHBondContact O-N 2.86Å
184	I	71.1	Confident	62.3	Low	29 Å²	29	77.2 Å²	77.2	15%	0.149	48%	0.481	C	S	.	.			trans	-81	115.6	178.7	-62.6	165.7	0	0	0	106.5	V163 K179 L182 S186	V163-I184 HydrophobicContact CB-CD1 3.99Å; V163-I184 HydrophobicContact CG1-CD1 4.42Å; V163-I184 HydrophobicContact CG2-CD1 3.51Å; K179-I184 PolarHBondContact O-N 3.48Å; L182-I184 HydrophobicContact CB-CD1 3.77Å; L182-I184 HydrophobicContact CB-CG1 3.94Å; L182-I184 HydrophobicContact CD1-CD1 4.13Å; L182-I184 PolarHBondContact O-N 3.39Å; I184-S186 PolarHBondContact O-N 3.17Å
185	A	62.8	Low	59.9	Low	87 Å²	87	86 Å²	86	72%	0.719	52%	0.519	S	S	*	.			trans	-49.6	112.4	175.1	0	0	0	0	0	108.7	G183 T187	G183-A185 PolarHBondContact O-N 2.86Å; A185-T187 PolarHBondContact O-N 2.8Å
186	S	54	Low	57.8	Low	63 Å²	63	89.8 Å²	89.8	44%	0.441	55%	0.545	S	S	.	.			trans	-58.7	111.5	174	-173	0	0	0	0	105.5	I184 S188	I184-S186 PolarHBondContact O-N 3.17Å; S186-S188 PolarHBondContact O-N 2.89Å; S186-S188 PolarHBondContact OG-N 3.37Å
187	T	51.2	Low	55.6	Low	128 Å²	128	91.5 Å²	91.5	79%	0.785	55%	0.552	S	S	*	*			trans	-68.8	65.6	155.4	32.7	0	0	0	0	105.6	A185 A189	A185-T187 PolarHBondContact O-N 2.8Å; T187-A189 PolarHBondContact O-N 3.4Å; T187-A189 VanDerWaalsContact O-N 3.12Å
188	S	38.4	Very low	53.5	Low	84 Å²	84	97.4 Å²	97.4	59%	0.587	58%	0.581	S	S	*	*			trans	-52.9	124.3	173.6	-174.8	0	0	0	0	104.9	S186 N190	S186-S188 PolarHBondContact O-N 2.89Å; S186-S188 PolarHBondContact OG-N 3.37Å; S188-N190 VanDerWaalsContact C-N 3.31Å; S188-N190 PolarHBondContact O-N 3.04Å
189	A	41.4	Very low	51.4	Low	73 Å²	73	105.2 Å²	105.2	60%	0.603	62%	0.615	S	S	*	*			trans	-46.5	104.7	171.1	0	0	0	0	0	106.8	T187 N191	T187-A189 PolarHBondContact O-N 3.4Å; T187-A189 VanDerWaalsContact O-N 3.12Å; A189-N191 PolarHBondContact O-N 3.28Å
190	N	32.8	Very low	49.6	Very low	96 Å²	96	109.1 Å²	109.1	51%	0.513	64%	0.643	S	S	.	*			trans	-73.4	65.6	173.2	-168.1	24	0	0	0	107.9	S188 G192	S188-N190 VanDerWaalsContact C-N 3.31Å; S188-N190 PolarHBondContact O-N 3.04Å; N190-G192 PolarHBondContact O-N 3.28Å; N190-G192 VanDerWaalsContact O-N 3.15Å; N190-G192 PolarHBondContact OD1-O 3.4Å
191	N	33.6	Very low	47.9	Very low	164 Å²	164	113.3 Å²	113.3	88%	0.877	65%	0.653	S	S	*	*			trans	-79.6	70.6	156.7	-72.5	-9.6	0	0	0	105.3	A189	A189-N191 PolarHBondContact O-N 3.28Å
192	G	34	Very low	46.4	Very low	35 Å²	35	115.8 Å²	115.8	36%	0.361	67%	0.665	S	S	.	*	S	Bend	trans	-178.4	65.3	-165.6	0	0	0	0	0	112.6	N190 N194	N190-G192 PolarHBondContact O-N 3.28Å; N190-G192 VanDerWaalsContact O-N 3.15Å; N190-G192 PolarHBondContact OD1-O 3.4Å; G192-N194 PolarHBondContact O-N 3.29Å
193	S	31.2	Very low	45	Very low	121 Å²	121	121 Å²	121	85%	0.846	69%	0.688	S	S	*	*			trans	53.1	38.6	149.9	65.8	0	0	0	0	118.8
194	N	32.9	Very low	43.6	Very low	130 Å²	130	122.9 Å²	122.9	70%	0.695	69%	0.688	S	S	*	*			trans	-95.1	107.1	149.2	-80.9	-29.6	0	0	0	107.4	G192 V196	G192-N194 PolarHBondContact O-N 3.29Å; N194-V196 PolarHBondContact O-N 2.95Å
195	K	32.8	Very low	42.3	Very low	209 Å²	209	126.9 Å²	126.9	91%	0.909	71%	0.713	S	S	*	*			trans	-49.7	80.4	161.6	-78.4	174.1	170.6	175.7	0	109.2	Q197	K195-Q197 VanDerWaalsContact C-N 3.31Å; K195-Q197 PolarHBondContact O-N 3.48Å; K195-Q197 VanDerWaalsContact O-N 3.14Å
196	V	38.4	Very low	41.4	Very low	127 Å²	127	131.7 Å²	131.7	77%	0.77	72%	0.721	S	S	*	*			trans	-67.3	106.5	149.4	-179.7	0	0	0	0	102.4	N194 E198	N194-V196 PolarHBondContact O-N 2.95Å; V196-E198 PolarHBondContact O-N 3.47Å
197	Q	37.9	Very low	41	Very low	159 Å²	159	134.9 Å²	134.9	74%	0.743	73%	0.733	S	S	*	*			trans	-49.7	108.5	170.8	-69.1	178.7	1.9	0	0	106.7	K195 K199	K195-Q197 VanDerWaalsContact C-N 3.31Å; K195-Q197 PolarHBondContact O-N 3.48Å; K195-Q197 VanDerWaalsContact O-N 3.14Å; Q197-K199 PolarHBondContact O-N 2.91Å
198	E	40.3	Very low	40.5	Very low	192 Å²	192	137.9 Å²	137.9	90%	0.897	73%	0.732	S	S	*	*			trans	-58	91.6	160.3	-86.5	-179.2	150.2	0	0	105.5	V196	V196-E198 PolarHBondContact O-N 3.47Å
199	K	40.3	Very low	40.6	Very low	164 Å²	164	143.4 Å²	143.4	71%	0.713	75%	0.745	S	S	*	*			trans	-70.1	128.2	154.3	-85.3	-179.2	175.8	174.7	0	105.5	Q197 I201	Q197-K199 PolarHBondContact O-N 2.91Å; K199-I201 PolarHBondContact O-N 3.08Å
200	P	46.2	Very low	40.6	Very low	110 Å²	110	145.2 Å²	145.2	71%	0.714	75%	0.749	S	S	*	*			trans	-55.2	119.5	174.9	22.9	-29.9	0	0	0	107.1	E202	P200-E202 PolarHBondContact O-N 3.18Å
201	I	47.8	Very low	40.9	Very low	165 Å²	165	149.5 Å²	149.5	85%	0.846	76%	0.763	S	S	*	*			trans	-71.9	93.1	170.2	-63	168.9	0	0	0	104.1	K199 E203	K199-I201 PolarHBondContact O-N 3.08Å; I201-E203 PolarHBondContact O-N 3.24Å
202	E	51.1	Low	41.4	Very low	173 Å²	173	149.2 Å²	149.2	81%	0.808	76%	0.761	S	S	*	*			trans	-55.5	132.4	165	-77.7	177.3	158.6	0	0	108.1	P200	P200-E202 PolarHBondContact O-N 3.18Å
203	E	48.8	Very low	41.5	Very low	165 Å²	165	156.7 Å²	156.7	77%	0.771	78%	0.784	S	S	*	*			trans	-48.5	138.7	177	-71.6	-177.3	147.4	0	0	110.1	I201 T205	I201-E203 PolarHBondContact O-N 3.24Å; E203-T205 PolarHBondContact O-N 2.74Å; E203-T205 PolarHBondContact O-OG1 2.68Å
204	P	47.9	Very low	42.1	Very low	107 Å²	107	158.3 Å²	158.3	70%	0.695	78%	0.781	S	S	*	*			trans	-69.8	85.1	179.6	30	-31.6	0	0	0	108.6
205	T	44.4	Very low	42.5	Very low	112 Å²	112	158.9 Å²	158.9	69%	0.687	78%	0.779	S	S	*	*			trans	-76	144.1	158.9	28.1	0	0	0	0	107.6	E203 N207	E203-T205 PolarHBondContact O-N 2.74Å; E203-T205 PolarHBondContact O-OG1 2.68Å; T205-N207 PolarHBondContact O-N 3.26Å
206	E	45.3	Very low	42.6	Very low	189 Å²	189	156 Å²	156	88%	0.883	77%	0.774	S	S	*	*	S	Bend	trans	-63	18.1	-164.6	-60.9	178.9	146.5	0	0	116.2
207	N	44.7	Very low	42.8	Very low	129 Å²	129	155.4 Å²	155.4	69%	0.69	77%	0.766	S	S	*	*			trans	-105.5	74	-179.3	-78.1	-36.4	0	0	0	112.3	T205 F209	T205-N207 PolarHBondContact O-N 3.26Å; N207-F209 PolarHBondContact O-N 3.34Å
208	Y	40.9	Very low	42.9	Very low	192 Å²	192	159.8 Å²	159.8	75%	0.753	78%	0.776	S	S	*	*			trans	-66.7	4.2	175.6	-78.1	-83.4	0	0	0	115.4
209	F	39.2	Very low	43	Very low	200 Å²	200	153.2 Å²	153.2	88%	0.877	76%	0.759	S	S	*	*			trans	-133.8	61.9	-176.1	-68.6	-80.8	0	0	0	113.1	N207	N207-F209 PolarHBondContact O-N 3.34Å
210	V	42.5	Very low	43.2	Very low	111 Å²	111	151.4 Å²	151.4	67%	0.673	77%	0.767	S	S	*	*			trans	-129.8	105.5	162.8	-175	0	0	0	0	110.8
211	K	39.4	Very low	43.5	Very low	186 Å²	186	155.3 Å²	155.3	81%	0.809	77%	0.768	S	S	*	*			trans	37.9	100.7	146	-68.6	172.9	174.8	172.3	0	115.9
212	N	42.8	Very low	44.1	Very low	157 Å²	157	157.5 Å²	157.5	84%	0.84	77%	0.771	S	S	*	*				-154.5	115.8	129	-96.1	-35.3	0	0	0	112.9
213	K	37.4	Very low	44.8	Very low	192 Å²	192	154.1 Å²	154.1	84%	0.835	76%	0.757	S	S	*	*			trans	70.9	65.4	159.4	-57.5	-176	179.6	-177.2	0	118	H215	K213-H215 PolarHBondContact O-N 3.29Å
214	I	42.5	Very low	46	Very low	155 Å²	155	148.7 Å²	148.7	80%	0.795	74%	0.738	S	S	*	*			trans	-75	101.9	144.1	-59.7	175.6	0	0	0	106.4	N216	I214-N216 PolarHBondContact O-N 3.49Å
215	H	42.2	Very low	47.1	Very low	143 Å²	143	148.6 Å²	148.6	66%	0.662	74%	0.735	S	S	*	*			trans	-58.4	125.2	162.2	64.2	-74.9	0	0	0	108	K213 L217	K213-H215 PolarHBondContact O-N 3.29Å; H215-L217 PolarHBondContact O-N 3.14Å
216	N	34.3	Very low	48.5	Very low	149 Å²	149	146.6 Å²	146.6	80%	0.797	72%	0.724	S	S	*	*			trans	-3.2	85.5	161	-59.8	-36.4	0	0	0	116.6	I214	I214-N216 PolarHBondContact O-N 3.49Å
217	L	42.2	Very low	49.8	Very low	114 Å²	114	143 Å²	143	60%	0.597	71%	0.707	S	S	*	*			trans	-101.2	60.5	154.2	-70.3	175.2	0	0	0	108.5	H215 G219	H215-L217 PolarHBondContact O-N 3.14Å; L217-G219 PolarHBondContact O-N 3.31Å
218	R	40.3	Very low	51	Low	251 Å²	251	142.9 Å²	142.9	95%	0.947	70%	0.701	S	S	*	*			trans	-88.3	27.3	174.9	-142.3	-177.2	-159.9	-155.5	5.3	112.4
219	G	42.4	Very low	52.4	Low	53 Å²	53	135.6 Å²	135.6	55%	0.546	68%	0.678	S	S	.	*	S	Bend	trans	-102.9	114.3	174.2	0	0	0	0	0	110.1	L217 R221	L217-G219 PolarHBondContact O-N 3.31Å; G219-R221 PolarHBondContact O-N 3.31Å
220	S	44.9	Very low	53.8	Low	127 Å²	127	130.6 Å²	130.6	89%	0.888	66%	0.66	S	S	*	*			trans	-34.2	95.9	172.6	163.6	0	0	0	0	113.1
221	R	51.6	Low	55.2	Low	192 Å²	192	127.8 Å²	127.8	73%	0.725	65%	0.649	S	S	*	*			trans	-109.3	128.4	163.7	-71.7	-173.6	-160.2	171.3	6.7	108.1	G219 I223	G219-R221 PolarHBondContact O-N 3.31Å; R221-I223 PolarHBondContact O-N 3.36Å
222	K	62.2	Low	56.4	Low	211 Å²	211	123.5 Å²	123.5	92%	0.917	63%	0.634	S	S	*	*			trans	-57.1	101.9	173.9	-68	175.7	177.9	178.2	0	108.7
223	I	64.7	Low	57.5	Low	101 Å²	101	116.6 Å²	116.6	52%	0.518	60%	0.599	S	S	.	*			trans	-67.8	128.4	175.7	-61.4	170.1	0	0	0	108	R221 Q227 K228	R221-I223 PolarHBondContact O-N 3.36Å; I223-Q227 HydrophobicContact CG2-CB 3.28Å; I223-Q227 HydrophobicContact CG2-CG 4.4Å; I223-K228 HydrophobicContact CB-CG 4.34Å; I223-K228 HydrophobicContact CG2-CG 3.88Å
224	S	73.9	Confident	58.8	Low	51 Å²	51	112.4 Å²	112.4	36%	0.357	59%	0.593	S	S	.	*			trans	-66.6	156.3	179.7	73.9	0	0	0	0	111.5	P226 Q227 K228	S224-P226 WeakPolarHBondContact OG-CD 3.48Å; S224-P226 WeakPolarHBondContact OG-CG 3.49Å; S224-Q227 VanDerWaalsContact N-OE1 3.07Å; S224-Q227 WeakPolarHBondContact O-CB 3.49Å; S224-Q227 PolarHBondContact O-N 2.94Å; S224-Q227 WeakPolarHBondContact OG-CG 3.44Å; S224-Q227 PolarHBondContact OG-OE1 2.86Å; S224-K228 PolarHBondContact O-N 2.88Å
225	T	72.1	Confident	60.2	Low	106 Å²	106	113 Å²	113	65%	0.65	59%	0.59	S	S	*	*	H	α-helix	trans	-51.2	-44.1	177.1	35.9	0	0	0	0	114.2	K228 S229	T225-K228 PolarHBondContact O-N 3.26Å; T225-S229 PolarHBondContact O-N 3.31Å
226	P	72.1	Confident	61	Low	70 Å²	70	109.5 Å²	109.5	46%	0.455	59%	0.593	S	S	.	*	H	α-helix	trans	-65.8	-37.1	174.6	20.4	-29	0	0	0	112.4	S224 K228 S229 L230 F243	S224-P226 WeakPolarHBondContact OG-CD 3.48Å; S224-P226 WeakPolarHBondContact OG-CG 3.49Å; P226-K228 VanDerWaalsContact C-N 3.34Å; P226-K228 PolarHBondContact O-N 2.92Å; P226-S229 PolarHBondContact O-N 2.91Å; P226-L230 WeakPolarHBondContact O-CB 3.43Å; P226-L230 PolarHBondContact O-N 2.97Å; P226-F243 HydrophobicContact CB-CZ 4.28Å; P226-F243 VanDerWaalsContact O-CE2 3.26Å; P226-F243 WeakPolarHBondContact O-CE2 3.46Å; P226-F243 WeakPolarHBondContact O-CZ 3.48Å
227	Q	73.2	Confident	62.5	Low	112 Å²	112	107.5 Å²	107.5	52%	0.523	59%	0.586	S	S	.	*	H	α-helix	trans	-66	-35.5	175.6	-71.8	174.6	-34	0	0	112.6	I223 S224 L230 A231	I223-Q227 HydrophobicContact CG2-CB 3.28Å; I223-Q227 HydrophobicContact CG2-CG 4.4Å; S224-Q227 VanDerWaalsContact N-OE1 3.07Å; S224-Q227 WeakPolarHBondContact O-CB 3.49Å; S224-Q227 PolarHBondContact O-N 2.94Å; S224-Q227 WeakPolarHBondContact OG-CG 3.44Å; S224-Q227 PolarHBondContact OG-OE1 2.86Å; Q227-L230 PolarHBondContact O-N 3.46Å; Q227-A231 WeakPolarHBondContact O-CB 3.39Å; Q227-A231 PolarHBondContact O-N 3.23Å
228	K	71	Confident	63.4	Low	127 Å²	127	103.5 Å²	103.5	55%	0.552	57%	0.569	S	S	*	*	H	α-helix	trans	-63.2	-44.3	171.9	-73.1	-173.9	-179.4	-178.8	0	111.6	I223 S224 T225 P226 L230 A231 L232	I223-K228 HydrophobicContact CB-CG 4.34Å; I223-K228 HydrophobicContact CG2-CG 3.88Å; S224-K228 PolarHBondContact O-N 2.88Å; T225-K228 PolarHBondContact O-N 3.26Å; P226-K228 VanDerWaalsContact C-N 3.34Å; P226-K228 PolarHBondContact O-N 2.92Å; K228-L230 VanDerWaalsContact C-N 3.3Å; K228-L230 PolarHBondContact O-N 2.99Å; K228-A231 PolarHBondContact O-N 3.46Å; K228-L232 WeakPolarHBondContact O-CG 3.4Å; K228-L232 PolarHBondContact O-N 2.89Å
229	S	69.9	Low	64.7	Low	40 Å²	40	95.6 Å²	95.6	28%	0.28	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-36.5	176.7	179.4	0	0	0	0	111.5	T225 P226 L232 A233 F243	T225-S229 PolarHBondContact O-N 3.31Å; P226-S229 PolarHBondContact O-N 2.91Å; S229-L232 PolarHBondContact O-N 3.22Å; S229-A233 PolarHBondContact O-N 3.02Å; S229-F243 VanDerWaalsContact C-CE2 3.49Å; S229-F243 VanDerWaalsContact OG-CD2 3.24Å; S229-F243 WeakPolarHBondContact OG-CD2 3.24Å; S229-F243 WeakPolarHBondContact OG-CE2 3.44Å
230	L	69.3	Low	65.8	Low	94 Å²	94	98.6 Å²	98.6	49%	0.492	55%	0.553	S	S	.	*	H	α-helix	trans	-72.7	-36.3	-178.6	-129.2	160.1	0	0	0	110.1	P226 Q227 K228 A233 S234 F243	P226-L230 WeakPolarHBondContact O-CB 3.43Å; P226-L230 PolarHBondContact O-N 2.97Å; Q227-L230 PolarHBondContact O-N 3.46Å; K228-L230 VanDerWaalsContact C-N 3.3Å; K228-L230 PolarHBondContact O-N 2.99Å; L230-A233 PolarHBondContact O-N 3.4Å; L230-S234 WeakPolarHBondContact O-CB 3.24Å; L230-S234 PolarHBondContact O-N 2.97Å; L230-F243 VanDerWaalsContact CA-CE2 3.45Å; L230-F243 HydrophobicContact CB-CD2 4.37Å; L230-F243 HydrophobicContact CB-CE2 3.55Å; L230-F243 HydrophobicContact CB-CZ 3.74Å; L230-F243 HydrophobicContact CD1-CE1 3.75Å; L230-F243 HydrophobicContact CD1-CE2 4.09Å; L230-F243 HydrophobicContact CD1-CZ 3.41Å; L230-F243 VanDerWaalsContact CD1-CZ 3.41Å; L230-F243 HydrophobicContact CG-CD2 4.18Å; L230-F243 HydrophobicContact CG-CE1 3.95Å; L230-F243 HydrophobicContact CG-CE2 3.57Å; L230-F243 HydrophobicContact CG-CZ 3.44Å; L230-F243 VanDerWaalsContact CG-CZ 3.44Å
231	A	70.4	Confident	67	Low	53 Å²	53	96 Å²	96	44%	0.438	54%	0.535	S	S	.	.	H	α-helix	trans	-67.4	-33.4	172.2	0	0	0	0	0	112.8	Q227 K228 K235	Q227-A231 WeakPolarHBondContact O-CB 3.39Å; Q227-A231 PolarHBondContact O-N 3.23Å; K228-A231 PolarHBondContact O-N 3.46Å; A231-K235 WeakPolarHBondContact O-CG 3.42Å; A231-K235 PolarHBondContact O-N 2.89Å
232	L	65.6	Low	67.7	Low	96 Å²	96	89.5 Å²	89.5	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-71.6	-41.4	173.8	-75.8	164.5	0	0	0	111.8	K228 S229 K235 T237	K228-L232 WeakPolarHBondContact O-CG 3.4Å; K228-L232 PolarHBondContact O-N 2.89Å; S229-L232 PolarHBondContact O-N 3.22Å; L232-K235 PolarHBondContact O-N 3.46Å; L232-T237 PolarHBondContact O-OG1 3.07Å
233	A	65.6	Low	67.8	Low	12 Å²	12	82.3 Å²	82.3	10%	0.099	49%	0.488	C	S	.	.	H	α-helix	trans	-64.8	-39.7	173.8	0	0	0	0	0	111.8	S229 L230 K235 G236 L240	S229-A233 PolarHBondContact O-N 3.02Å; L230-A233 PolarHBondContact O-N 3.4Å; A233-K235 VanDerWaalsContact C-N 3.26Å; A233-K235 PolarHBondContact O-N 3.37Å; A233-G236 PolarHBondContact O-N 3.36Å; A233-G236 VanDerWaalsContact O-N 3.14Å; A233-L240 HydrophobicContact CB-CD2 4.41Å
234	S	65.4	Low	68.1	Low	103 Å²	103	85.4 Å²	85.4	72%	0.72	50%	0.498	S	S	*	.	H	α-helix	trans	-64.8	-25	177.3	166.7	0	0	0	0	114	L230 G236	L230-S234 WeakPolarHBondContact O-CB 3.24Å; L230-S234 PolarHBondContact O-N 2.97Å; S234-G236 VanDerWaalsContact C-N 3.26Å; S234-G236 PolarHBondContact O-N 2.99Å
235	K	70.2	Confident	67.8	Low	168 Å²	168	87.2 Å²	87.2	73%	0.73	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	1.4	176.5	-76.3	-177	177.5	-173	0	113.4	A231 L232 A233 T237	A231-K235 WeakPolarHBondContact O-CG 3.42Å; A231-K235 PolarHBondContact O-N 2.89Å; L232-K235 PolarHBondContact O-N 3.46Å; A233-K235 VanDerWaalsContact C-N 3.26Å; A233-K235 PolarHBondContact O-N 3.37Å; K235-T237 PolarHBondContact O-N 3.02Å
236	G	60.3	Low	66.8	Low	69 Å²	69	94.7 Å²	94.7	71%	0.711	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	5.6	179.8	0	0	0	0	0	114.6	A233 S234	A233-G236 PolarHBondContact O-N 3.36Å; A233-G236 VanDerWaalsContact O-N 3.14Å; S234-G236 VanDerWaalsContact C-N 3.26Å; S234-G236 PolarHBondContact O-N 2.99Å
237	T	65.1	Low	66.6	Low	107 Å²	107	95.9 Å²	95.9	66%	0.656	54%	0.538	S	S	*	.	S	Bend	trans	-90.2	-6.7	-177.7	55.6	0	0	0	0	113.7	L232 K235	L232-T237 PolarHBondContact O-OG1 3.07Å; K235-T237 PolarHBondContact O-N 3.02Å
238	A	61.1	Low	66.2	Low	30 Å²	30	95.1 Å²	95.1	25%	0.248	54%	0.539	C	S	.	.	S	Bend	trans	-138.7	137.4	175.5	0	0	0	0	0	109.6	L240	A238-L240 PolarHBondContact O-N 3.05Å
239	P	68.8	Low	66	Low	85 Å²	85	93.3 Å²	93.3	55%	0.552	54%	0.538	S	S	*	.			trans	-64.1	135.6	177.3	27.9	-33.6	0	0	0	109.6	S241 S242	P239-S241 WeakPolarHBondContact CB-OG 3.26Å; P239-S241 PolarHBondContact O-N 3.11Å; P239-S242 WeakPolarHBondContact O-CB 3.38Å; P239-S242 PolarHBondContact O-N 3.03Å; P239-S242 PolarHBondContact O-OG 3.19Å
240	L	64.5	Low	65.7	Low	116 Å²	116	96.4 Å²	96.4	61%	0.607	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-24.4	176.6	-94.1	156.7	0	0	0	113	A233 A238 S242 F243 F244	A233-L240 HydrophobicContact CB-CD2 4.41Å; A238-L240 PolarHBondContact O-N 3.05Å; L240-S242 PolarHBondContact O-N 2.88Å; L240-F243 VanDerWaalsContact O-CB 3.24Å; L240-F243 WeakPolarHBondContact O-CB 3.43Å; L240-F243 PolarHBondContact O-N 3.24Å; L240-F244 WeakPolarHBondContact O-CD2 3.48Å
241	S	69.7	Low	65.5	Low	73 Å²	73	96.6 Å²	96.6	51%	0.51	56%	0.557	S	S	.	*	H	α-helix	trans	-56.5	-36.2	172.8	56.6	0	0	0	0	112.6	P239 F243 F244 S245	P239-S241 WeakPolarHBondContact CB-OG 3.26Å; P239-S241 PolarHBondContact O-N 3.11Å; S241-F243 PolarHBondContact O-N 3.45Å; S241-F243 VanDerWaalsContact O-N 3.11Å; S241-F244 PolarHBondContact O-N 2.93Å; S241-F244 VanDerWaalsContact O-N 3.07Å; S241-S245 PolarHBondContact O-N 3.44Å; S241-S245 PolarHBondContact O-OG 2.93Å
242	S	67.1	Low	65.2	Low	55 Å²	55	99.5 Å²	99.5	39%	0.385	57%	0.565	S	S	.	*	H	α-helix	trans	-66.7	-14	177.3	73	0	0	0	0	113.3	P239 L240	P239-S242 WeakPolarHBondContact O-CB 3.38Å; P239-S242 PolarHBondContact O-N 3.03Å; P239-S242 PolarHBondContact O-OG 3.19Å; L240-S242 PolarHBondContact O-N 2.88Å
243	F	63.4	Low	65.2	Low	60 Å²	60	99.7 Å²	99.7	26%	0.263	57%	0.57	S	S	.	*	H	α-helix	trans	-80.6	-29.7	174.6	-151	-91.9	0	0	0	112.6	P226 S229 L230 L240 S241	P226-F243 HydrophobicContact CB-CZ 4.28Å; P226-F243 VanDerWaalsContact O-CE2 3.26Å; P226-F243 WeakPolarHBondContact O-CE2 3.46Å; P226-F243 WeakPolarHBondContact O-CZ 3.48Å; S229-F243 VanDerWaalsContact C-CE2 3.49Å; S229-F243 VanDerWaalsContact OG-CD2 3.24Å; S229-F243 WeakPolarHBondContact OG-CD2 3.24Å; S229-F243 WeakPolarHBondContact OG-CE2 3.44Å; L230-F243 VanDerWaalsContact CA-CE2 3.45Å; L230-F243 HydrophobicContact CB-CD2 4.37Å; L230-F243 HydrophobicContact CB-CE2 3.55Å; L230-F243 HydrophobicContact CB-CZ 3.74Å; L230-F243 HydrophobicContact CD1-CE1 3.75Å; L230-F243 HydrophobicContact CD1-CE2 4.09Å; L230-F243 HydrophobicContact CD1-CZ 3.41Å; L230-F243 VanDerWaalsContact CD1-CZ 3.41Å; L230-F243 HydrophobicContact CG-CD2 4.18Å; L230-F243 HydrophobicContact CG-CE1 3.95Å; L230-F243 HydrophobicContact CG-CE2 3.57Å; L230-F243 HydrophobicContact CG-CZ 3.44Å; L230-F243 VanDerWaalsContact CG-CZ 3.44Å; L240-F243 VanDerWaalsContact O-CB 3.24Å; L240-F243 WeakPolarHBondContact O-CB 3.43Å; L240-F243 PolarHBondContact O-N 3.24Å; S241-F243 PolarHBondContact O-N 3.45Å; S241-F243 VanDerWaalsContact O-N 3.11Å
244	F	71.8	Confident	65.1	Low	167 Å²	167	106.5 Å²	106.5	73%	0.732	61%	0.606	S	S	*	*	H	α-helix	trans	-96.4	-15.1	179.2	-64.3	-77.2	0	0	0	113.1	L240 S241 K246	L240-F244 WeakPolarHBondContact O-CD2 3.48Å; S241-F244 PolarHBondContact O-N 2.93Å; S241-F244 VanDerWaalsContact O-N 3.07Å; F244-K246 PolarHBondContact O-N 3.33Å
245	S	66.4	Low	65.1	Low	89 Å²	89	106.8 Å²	106.8	62%	0.622	60%	0.596	S	S	*	*			trans	-83	84.9	172.4	-52.8	0	0	0	0	110.5	S241	S241-S245 PolarHBondContact O-N 3.44Å; S241-S245 PolarHBondContact O-OG 2.93Å
246	K	52.8	Low	64.6	Low	262 Å²	262	101.2 Å²	101.2	100%	1.139	58%	0.584	S	S	*	*			trans	-141.9	0	161.6	-110.2	-169.9	179.6	-172	0	110.9	F244	F244-K246 PolarHBondContact O-N 3.33Å

Retrieved 246 of 246 residues in 97.5 ms (Link to these results)

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