A0A077YWH5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YWH5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 264 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	33.9	Very low	30.1	Very low	246 Å²	246	145.1 Å²	145.1	100%	1.212	81%	0.813	S	S	*	*				0	136	0	-70	170.5	77.4	0	0	107.4
2	S	31.2	Very low	29.7	Very low	100 Å²	100	142.5 Å²	142.5	70%	0.699	80%	0.803	S	S	*	*			trans	-47.2	126.9	-153.8	-118.6	0	0	0	0	118.3	T4	S2-T4 VanDerWaalsContact C-N 3.31Å; S2-T4 PolarHBondContact OG-OG1 2.74Å
3	A	27.8	Very low	29.6	Very low	102 Å²	102	139.3 Å²	139.3	84%	0.843	79%	0.792	S	S	*	*			trans	-94	31.2	166.4	0	0	0	0	0	112.4
4	T	31.9	Very low	29.4	Very low	116 Å²	116	145.4 Å²	145.4	71%	0.712	80%	0.798	S	S	*	*			trans	-111.2	22.3	-170.8	3.7	0	0	0	0	114.2	S2	S2-T4 VanDerWaalsContact C-N 3.31Å; S2-T4 PolarHBondContact OG-OG1 2.74Å
5	L	29.2	Very low	29.2	Very low	148 Å²	148	148.7 Å²	148.7	78%	0.775	80%	0.802	S	S	*	*	S	Bend	trans	-127.2	5.9	-174.4	-118.6	137.2	0	0	0	115.4
6	I	30.8	Very low	28.9	Very low	141 Å²	141	143 Å²	143	72%	0.723	79%	0.789	S	S	*	*	S	Bend	trans	-99.1	-7.9	-175.8	-63.3	175.3	0	0	0	113.1
7	A	28.4	Very low	28.5	Very low	86 Å²	86	146.4 Å²	146.4	71%	0.711	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-7.8	-176.7	0	0	0	0	0	115.6
8	F	30.6	Very low	28.3	Very low	198 Å²	198	147.7 Å²	147.7	87%	0.868	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-4.6	-176.4	-100.8	-86.1	0	0	0	115.3
9	L	29.1	Very low	28	Very low	150 Å²	150	144.6 Å²	144.6	79%	0.785	79%	0.791	S	S	*	*	S	Bend	trans	-105.6	4.5	-176.4	-81.5	162.9	0	0	0	114.8
10	L	28.7	Very low	27.9	Very low	149 Å²	149	146.1 Å²	146.1	78%	0.78	79%	0.792	S	S	*	*	S	Bend	trans	-111	11.4	-175.9	-69.5	173.3	0	0	0	115.1
11	L	29.6	Very low	27.7	Very low	160 Å²	160	144.6 Å²	144.6	84%	0.838	79%	0.793	S	S	*	*	S	Bend	trans	-124.2	21.3	179	-78.2	168.5	0	0	0	114.6	P13	L11-P13 WeakPolarHBondContact O-CD 3.27Å
12	V	25.5	Very low	27.2	Very low	114 Å²	114	138.2 Å²	138.2	69%	0.691	77%	0.772	S	S	*	*			trans	-100.4	95.4	165	-175.1	0	0	0	0	107.9	Y14	V12-Y14 PolarHBondContact O-N 3.35Å
13	P	28.7	Very low	27.1	Very low	101 Å²	101	138.8 Å²	138.8	66%	0.656	77%	0.774	S	S	*	*			trans	-65.5	121	162.3	28.7	-28.9	0	0	0	106.8	L11 F15	L11-P13 WeakPolarHBondContact O-CD 3.27Å; P13-F15 PolarHBondContact O-N 3.46Å
14	Y	26.5	Very low	26.9	Very low	224 Å²	224	138.1 Å²	138.1	88%	0.878	77%	0.768	S	S	*	*			trans	-25.3	104.5	165.6	-99.8	-113	0	0	0	112.7	V12 G16	V12-Y14 PolarHBondContact O-N 3.35Å; Y14-G16 PolarHBondContact O-N 3.49Å
15	F	26.9	Very low	26.6	Very low	195 Å²	195	140.5 Å²	140.5	86%	0.855	78%	0.776	S	S	*	*			trans	-73.3	80.7	157.9	-85.6	-86.4	0	0	0	107.9	P13 F17	P13-F15 PolarHBondContact O-N 3.46Å; F15-F17 PolarHBondContact O-N 2.92Å
16	G	23.3	Very low	26.4	Very low	58 Å²	58	137.5 Å²	137.5	60%	0.598	77%	0.773	S	S	*	*			trans	-72.2	104.1	164.6	0	0	0	0	0	109.1	Y14 H18	Y14-G16 PolarHBondContact O-N 3.49Å; G16-H18 PolarHBondContact O-N 3.17Å
17	F	22.9	Very low	26.2	Very low	201 Å²	201	137.5 Å²	137.5	88%	0.882	78%	0.779	S	S	*	*			trans	-59.6	97.1	163.1	-109.8	-98	0	0	0	108.7	F15	F15-F17 PolarHBondContact O-N 2.92Å
18	H	23.8	Very low	26	Very low	169 Å²	169	138.1 Å²	138.1	78%	0.782	78%	0.776	S	S	*	*			trans	-93.7	84.8	157.8	-100.3	-77.2	0	0	0	108	G16 E20	G16-H18 PolarHBondContact O-N 3.17Å; H18-E20 VanDerWaalsContact C-N 3.32Å; H18-E20 PolarHBondContact O-N 3.44Å
19	A	24.2	Very low	25.8	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	77%	0.771	S	S	*	*			trans	-83.2	82.3	161.5	0	0	0	0	0	107.7
20	E	25.2	Very low	26.1	Very low	175 Å²	175	132.2 Å²	132.2	82%	0.818	77%	0.766	S	S	*	*			trans	-91.7	116.4	162.7	-98.6	-178.1	147.1	0	0	109.2	H18	H18-E20 VanDerWaalsContact C-N 3.32Å; H18-E20 PolarHBondContact O-N 3.44Å
21	S	23.8	Very low	26.4	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	75%	0.753	S	S	*	*			trans	-68	148.5	175.8	49.1	0	0	0	0	113.1
22	S	23.3	Very low	26.8	Very low	111 Å²	111	128 Å²	128	78%	0.776	75%	0.747	S	S	*	*			trans	116.2	147.1	144.5	-149.4	0	0	0	0	115.2
23	P	28.8	Very low	27.9	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	74%	0.744	S	S	*	*			cis	-132.8	170.5	-39.4	32.3	-14.8	0	0	0	113.1
24	A	24.1	Very low	29.1	Very low	87 Å²	87	124 Å²	124	72%	0.719	73%	0.732	S	S	*	*			trans	6.2	111.1	157.6	0	0	0	0	0	118.1
25	N	25.3	Very low	30.6	Very low	166 Å²	166	116.9 Å²	116.9	89%	0.888	71%	0.707	S	S	*	*			trans	-174.9	137.2	133	-93.4	-32.9	0	0	0	112
26	A	24.7	Very low	32.5	Very low	85 Å²	85	109.8 Å²	109.8	70%	0.702	68%	0.681	S	S	*	*			trans	56	106.8	165.3	0	0	0	0	0	117.2	P28	A26-P28 WeakPolarHBondContact O-CD 2.88Å
27	V	25.9	Very low	35	Very low	142 Å²	142	110.2 Å²	110.2	86%	0.861	67%	0.666	S	S	*	*			trans	-54.8	108.9	148.1	177.4	0	0	0	0	105.8	A29	V27-A29 PolarHBondContact O-N 3.13Å
28	P	25.7	Very low	37.4	Very low	99 Å²	99	102.8 Å²	102.8	64%	0.643	63%	0.632	S	S	*	*			trans	-69.2	128	175.9	17.4	-8	0	0	0	105.9	A26 I30	A26-P28 WeakPolarHBondContact O-CD 2.88Å; P28-I30 PolarHBondContact O-N 3.09Å
29	A	26.1	Very low	40.1	Very low	93 Å²	93	94.8 Å²	94.8	77%	0.769	60%	0.595	S	S	*	*			trans	-47.9	114.8	162.6	0	0	0	0	0	106.3	V27 S31	V27-A29 PolarHBondContact O-N 3.13Å; A29-S31 VanDerWaalsContact C-N 3.28Å; A29-S31 PolarHBondContact O-N 2.87Å
30	I	35.3	Very low	42.9	Very low	131 Å²	131	91.4 Å²	91.4	67%	0.672	57%	0.566	S	S	*	*			trans	-56.2	101.1	177.9	-60.6	171.5	0	0	0	104.8	P28 M32 S34	P28-I30 PolarHBondContact O-N 3.09Å; I30-M32 PolarHBondContact O-N 3.17Å; I30-S34 VanDerWaalsContact CG2-OG 3.23Å; I30-S34 WeakPolarHBondContact CG2-OG 3.44Å
31	S	34.7	Very low	45.7	Very low	72 Å²	72	83.1 Å²	83.1	50%	0.503	53%	0.527	S	S	.	.			trans	-60.5	131.4	179.3	78.5	0	0	0	0	105.4	A29 A33 S34	A29-S31 VanDerWaalsContact C-N 3.28Å; A29-S31 PolarHBondContact O-N 2.87Å; S31-A33 PolarHBondContact O-N 3.43Å; S31-S34 PolarHBondContact O-N 3.37Å; S31-S34 PolarHBondContact O-OG 3.33Å
32	M	39	Very low	48.7	Very low	148 Å²	148	78 Å²	78	73%	0.729	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-57.8	-6.5	178.4	-68.1	-158.1	173.1	0	0	112.9	I30 S34 M35	I30-M32 PolarHBondContact O-N 3.17Å; M32-S34 VanDerWaalsContact C-N 3.25Å; M32-S34 PolarHBondContact O-N 3.48Å; M32-M35 HydrophobicContact CB-CE 4.19Å; M32-M35 HydrophobicContact CG-CE 3.85Å; M32-M35 HydrophobicContact SD-CE 4.36Å
33	A	47	Very low	51.8	Low	75 Å²	75	72.8 Å²	72.8	62%	0.62	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-69.6	-16.3	170.2	0	0	0	0	0	114.1	S31 I113	S31-A33 PolarHBondContact O-N 3.43Å; A33-I113 WeakPolarHBondContact O-CG2 3.48Å
34	S	55.6	Low	54.6	Low	57 Å²	57	68.5 Å²	68.5	40%	0.399	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-96.2	-4.4	-179.1	62.5	0	0	0	0	114.4	I30 S31 M32 I113	I30-S34 VanDerWaalsContact CG2-OG 3.23Å; I30-S34 WeakPolarHBondContact CG2-OG 3.44Å; S31-S34 PolarHBondContact O-N 3.37Å; S31-S34 PolarHBondContact O-OG 3.33Å; M32-S34 VanDerWaalsContact C-N 3.25Å; M32-S34 PolarHBondContact O-N 3.48Å; S34-I113 WeakPolarHBondContact O-CD1 3.35Å
35	M	56.7	Low	57.7	Low	73 Å²	73	64.4 Å²	64.4	36%	0.36	39%	0.393	S	S	.	.	S	Bend	trans	-87.5	132.5	179.1	-73	-166.7	-75.3	0	0	111.1	M32 K37	M32-M35 HydrophobicContact CB-CE 4.19Å; M32-M35 HydrophobicContact CG-CE 3.85Å; M32-M35 HydrophobicContact SD-CE 4.36Å; M35-K37 PolarHBondContact O-N 3.07Å
36	P	67.6	Low	60.5	Low	47 Å²	47	59.8 Å²	59.8	31%	0.305	37%	0.371	S	S	.	.			trans	-62.6	127.7	175	24.4	-33.3	0	0	0	110.6	Q90 I113	P36-Q90 HydrophobicContact CB-CG 4.1Å; P36-Q90 VanDerWaalsContact CB-NE2 3.25Å; P36-Q90 VanDerWaalsContact CG-NE2 3.27Å; P36-I113 HydrophobicContact CB-CG1 3.91Å
37	K	76.1	Confident	63.4	Low	67 Å²	67	57.5 Å²	57.5	29%	0.291	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	153.1	178	-58.7	-176.7	178.7	175.7	0	109.4	M35 Y39 G111 A112 V216	M35-K37 PolarHBondContact O-N 3.07Å; K37-Y39 HydrophobicContact CB-CE2 3.77Å; K37-G111 CarbonylContact O-C 3.57Å; K37-G111 WeakPolarHBondContact O-CA 3.01Å; K37-A112 PolarHBondContact N-O 3.25Å; K37-A112 PolarHBondContact O-N 2.72Å; K37-V216 HydrophobicContact CB-CB 4.25Å; K37-V216 HydrophobicContact CB-CG2 3.86Å; K37-V216 HydrophobicContact CD-CB 4.38Å; K37-V216 HydrophobicContact CD-CG1 4.23Å; K37-V216 HydrophobicContact CD-CG2 4.17Å; K37-V216 HydrophobicContact CG-CB 4.49Å; K37-V216 HydrophobicContact CG-CG2 3.88Å
38	R	73.4	Confident	66.3	Low	44 Å²	44	51 Å²	51	17%	0.166	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.4	168.3	-66.4	-177.2	-146.4	-171.2	-1.4	110	Y91 V110 R213 V216	R38-Y91 WeakPolarHBondContact CD-OH 3.5Å; R38-Y91 VanDerWaalsContact CG-OH 3.26Å; R38-Y91 WeakPolarHBondContact CG-OH 3.42Å; R38-V110 CarbonylContact C-O 3.57Å; R38-V110 WeakPolarHBondContact CA-O 3.25Å; R38-R213 VanDerWaalsContact NH2-CA 3.34Å; R38-V216 PolarHBondContact O-N 3.4Å
39	Y	80.1	Confident	69.4	Low	1 Å²	1	50.7 Å²	50.7	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.6	175.8	-58.2	-87.5	0	0	0	109.5	K37 E109 V110 A112 A114 L116 M119	K37-Y39 HydrophobicContact CB-CE2 3.77Å; Y39-E109 CarbonylContact O-C 3.46Å; Y39-E109 WeakPolarHBondContact O-CA 3.32Å; Y39-V110 WeakPolarHBondContact CD2-O 3.37Å; Y39-V110 PolarHBondContact N-O 3.5Å; Y39-V110 PolarHBondContact O-N 3.01Å; Y39-A112 HydrophobicContact CE2-CB 4.32Å; Y39-A114 HydrophobicContact CE2-CB 4.26Å; Y39-A114 PolarHBondContact OH-O 3.38Å; Y39-L116 HydrophobicContact CD1-CD1 4.47Å; Y39-M119 HydrophobicContact CD1-CB 4.09Å; Y39-M119 HydrophobicContact CD1-CG 3.71Å; Y39-M119 HydrophobicContact CD2-CE 4.41Å; Y39-M119 HydrophobicContact CD2-CG 3.71Å; Y39-M119 HydrophobicContact CD2-SD 4.21Å; Y39-M119 HydrophobicContact CE1-CB 4.38Å; Y39-M119 HydrophobicContact CE1-CG 3.76Å; Y39-M119 HydrophobicContact CE2-CG 3.78Å; Y39-M119 HydrophobicContact CE2-SD 4.36Å; Y39-M119 HydrophobicContact CG-CB 4.27Å; Y39-M119 HydrophobicContact CG-CG 3.68Å
40	C	81.8	Confident	72.6	Confident	18 Å²	18	47.9 Å²	47.9	12%	0.122	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.2	168.5	-69.2	0	0	0	0	107.7	F228	C40-F228 HydrophobicContact CB-CD1 4.15Å; C40-F228 HydrophobicContact CB-CD2 3.51Å; C40-F228 HydrophobicContact CB-CE1 4.23Å; C40-F228 HydrophobicContact CB-CE2 3.63Å; C40-F228 HydrophobicContact CB-CG 3.82Å; C40-F228 HydrophobicContact CB-CZ 3.99Å
41	M	84.1	Confident	75.3	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	157.8	-172.9	-29.3	-172.8	-43.6	0	0	110.2	L108 V110 M119 V122 T123 V220	M41-L108 HydrophobicContact CB-CB 4.42Å; M41-L108 HydrophobicContact CE-CB 4.33Å; M41-L108 HydrophobicContact CE-CD1 4.08Å; M41-L108 PolarHBondContact N-O 3.09Å; M41-L108 PolarHBondContact O-N 2.87Å; M41-V110 HydrophobicContact CE-CG2 3.75Å; M41-V110 HydrophobicContact SD-CB 4.46Å; M41-V110 HydrophobicContact SD-CG2 4.01Å; M41-M119 HydrophobicContact CE-CE 4.27Å; M41-M119 HydrophobicContact SD-CB 4.35Å; M41-M119 HydrophobicContact SD-CE 3.4Å; M41-M119 WeakPolarHBondContact SD-CE 3.43Å; M41-V122 HydrophobicContact CE-CG1 4.29Å; M41-T123 WeakPolarHBondContact CE-OG1 3.39Å; M41-T123 PolarHBondContact SD-OG1 3.17Å; M41-V220 HydrophobicContact CG-CG2 4.47Å
42	S	87.2	Confident	78	Confident	9 Å²	9	48.1 Å²	48.1	6%	0.063	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.3	164.8	74.4	0	0	0	0	111.8	K105 V106 T123 I223	S42-K105 WeakPolarHBondContact OG-CE 3.49Å; S42-V106 WeakPolarHBondContact CA-O 3.34Å; S42-T123 WeakPolarHBondContact O-CG2 2.96Å; S42-I223 WeakPolarHBondContact OG-CD1 3.19Å
43	A	87.8	Confident	80.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	135.2	176	0	0	0	0	0	110.1	K105 V106 T123 L126 Q127	A43-K105 CarbonylContact O-C 3.57Å; A43-K105 WeakPolarHBondContact O-CA 3.21Å; A43-V106 HydrophobicContact CB-CG1 4.08Å; A43-V106 PolarHBondContact N-O 3.41Å; A43-V106 WeakPolarHBondContact O-CG1 3.48Å; A43-V106 PolarHBondContact O-N 3.35Å; A43-T123 HydrophobicContact CB-CG2 4.27Å; A43-L126 HydrophobicContact CB-CB 4.05Å; A43-Q127 HydrophobicContact CB-CG 3.86Å
44	V	88.6	Confident	82.3	Confident	24 Å²	24	43.7 Å²	43.7	15%	0.145	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.2	166.6	-178.3	0	0	0	0	107.3	T46 E100 L103 K105	V44-T46 PolarHBondContact O-N 3.25Å; V44-E100 HydrophobicContact CG2-CB 4.34Å; V44-E100 HydrophobicContact CG2-CG 4.21Å; V44-E100 VanDerWaalsContact CG2-OE2 3.24Å; V44-E100 WeakPolarHBondContact CG2-OE2 3.26Å; V44-L103 HydrophobicContact CG1-CB 3.7Å; V44-L103 HydrophobicContact CG1-CD1 4.01Å; V44-K105 HydrophobicContact CG2-CB 4.35Å; V44-K105 HydrophobicContact CG2-CG 4.21Å
45	L	88.2	Confident	83.9	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	95.5	175.7	-52.7	-177.7	0	0	0	107.6	D47 V48 F68 V72 T104 V106 L126 Y136	L45-D47 PolarHBondContact O-N 2.85Å; L45-V48 HydrophobicContact CB-CB 4.07Å; L45-V48 HydrophobicContact CB-CG2 4.21Å; L45-V48 HydrophobicContact CD1-CG2 4.48Å; L45-V48 PolarHBondContact O-N 3.3Å; L45-V48 VanDerWaalsContact O-N 3.14Å; L45-F68 HydrophobicContact CD1-CE1 4.33Å; L45-F68 HydrophobicContact CD1-CZ 3.78Å; L45-V72 HydrophobicContact CD1-CG2 4.41Å; L45-T104 WeakPolarHBondContact CB-O 3.2Å; L45-T104 HydrophobicContact CD1-CG2 4.24Å; L45-T104 PolarHBondContact N-O 3.1Å; L45-V106 HydrophobicContact CD2-CG1 4.04Å; L45-V106 HydrophobicContact CG-CG1 4.26Å; L45-L126 HydrophobicContact CD2-CD2 3.86Å; L45-Y136 HydrophobicContact CB-CE2 4.36Å; L45-Y136 HydrophobicContact CD1-CD2 4.15Å; L45-Y136 HydrophobicContact CD1-CE2 4.17Å; L45-Y136 HydrophobicContact CD2-CE1 3.94Å; L45-Y136 HydrophobicContact CD2-CE2 4.33Å
46	T	85	Confident	85.5	Confident	69 Å²	69	38.4 Å²	38.4	42%	0.423	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	-16.7	-171.9	52.1	0	0	0	0	114.4	V44 Q127	V44-T46 PolarHBondContact O-N 3.25Å; T46-Q127 PolarHBondContact OG1-O 3Å
47	D	84.8	Confident	86.4	Confident	38 Å²	38	37.9 Å²	37.9	20%	0.203	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	6.4	-175.1	-57	-55.9	0	0	0	113.5	L45 K132 Y137	L45-D47 PolarHBondContact O-N 2.85Å; D47-K132 HydrophobicContact CB-CG 4.27Å; D47-K132 WeakPolarHBondContact OD1-CE 3.44Å; D47-K132 IonicContact OD1-NZ 3.86Å; D47-K132 PolarHBondContact OD1-NZ 3.34Å; D47-K132 VanDerWaalsContact OD1-NZ 3.14Å; D47-K132 WeakPolarHBondContact OD2-CE 3.34Å; D47-K132 WeakPolarHBondContact OD2-CG 3.42Å; D47-Y137 HydrophobicContact CB-CD2 3.91Å; D47-Y137 HydrophobicContact CB-CE2 3.76Å
48	V	88	Confident	86.8	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.03	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	103.8	-178.2	-172.9	0	0	0	0	110.2	L45 M55 F68 T104 Y136 Y137	L45-V48 HydrophobicContact CB-CB 4.07Å; L45-V48 HydrophobicContact CB-CG2 4.21Å; L45-V48 HydrophobicContact CD1-CG2 4.48Å; L45-V48 PolarHBondContact O-N 3.3Å; L45-V48 VanDerWaalsContact O-N 3.14Å; V48-M55 HydrophobicContact CG1-CE 3.84Å; V48-F68 HydrophobicContact CG1-CZ 3.94Å; V48-T104 WeakPolarHBondContact O-CB 3.17Å; V48-T104 PolarHBondContact O-N 3.44Å; V48-T104 PolarHBondContact O-OG1 2.99Å; V48-Y136 HydrophobicContact CG2-CD2 3.89Å; V48-Y136 HydrophobicContact CG2-CE2 3.64Å; V48-Y137 HydrophobicContact CG2-CD2 4.49Å
49	P	91.1	Very high	87.4	Confident	92 Å²	92	42.9 Å²	42.9	60%	0.597	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.8	145.4	173.3	-21.5	32.3	0	0	0	111.6	D51 M55 D102 T104	P49-D51 PolarHBondContact O-N 2.7Å; P49-M55 WeakPolarHBondContact O-CE 3.34Å; P49-D102 WeakPolarHBondContact CA-O 3.25Å; P49-T104 PolarHBondContact O-OG1 2.61Å
50	F	92.8	Very high	87.6	Confident	34 Å²	34	46 Å²	46	15%	0.149	24%	0.237	C	C	.	.			trans	-75	115.7	176.5	-173	-92	0	0	0	111.3	K52 M55 P56 F97 R98 N99 D102 T104	F50-K52 HydrophobicContact CD1-CG 3.96Å; F50-K52 HydrophobicContact CE1-CG 3.84Å; F50-M55 HydrophobicContact CB-SD 4.42Å; F50-M55 HydrophobicContact CD2-CB 4.12Å; F50-M55 HydrophobicContact CD2-SD 3.58Å; F50-M55 VanDerWaalsContact CD2-SD 3.58Å; F50-M55 HydrophobicContact CE1-CB 4.46Å; F50-M55 HydrophobicContact CE2-CB 3.58Å; F50-M55 HydrophobicContact CE2-CG 4.44Å; F50-M55 HydrophobicContact CE2-SD 4Å; F50-M55 HydrophobicContact CG-SD 4.08Å; F50-M55 HydrophobicContact CZ-CB 3.78Å; F50-P56 HydrophobicContact CE1-CG 4.36Å; F50-P56 HydrophobicContact CZ-CG 4.23Å; F50-F97 HydrophobicContact CE2-CB 3.94Å; F50-R98 VanDerWaalsContact CD2-C 3.45Å; F50-R98 VanDerWaalsContact CD2-O 3.31Å; F50-R98 WeakPolarHBondContact CD2-O 2.93Å; F50-R98 VanDerWaalsContact CE2-C 3.4Å; F50-N99 HydrophobicContact CB-CB 4.12Å; F50-N99 HydrophobicContact CD1-CB 3.75Å; F50-N99 HydrophobicContact CD2-CB 4.26Å; F50-N99 HydrophobicContact CE1-CB 4.2Å; F50-N99 HydrophobicContact CG-CB 3.77Å; F50-D102 PolarHBondContact N-O 2.87Å; F50-T104 WeakPolarHBondContact CA-OG1 3.29Å; F50-T104 HydrophobicContact CD2-CG2 4.44Å
51	D	91.1	Very high	87.5	Confident	60 Å²	60	51 Å²	51	32%	0.321	27%	0.267	S	S	.	.			trans	-98.8	106	176.4	-167.1	-25.9	0	0	0	111.6	P49 T53 F54 M55	P49-D51 PolarHBondContact O-N 2.7Å; D51-T53 PolarHBondContact O-N 3.45Å; D51-T53 VanDerWaalsContact O-N 3.09Å; D51-T53 WeakPolarHBondContact OD1-CA 3.33Å; D51-T53 WeakPolarHBondContact OD1-CB 3.49Å; D51-T53 PolarHBondContact OD1-N 3.33Å; D51-T53 PolarHBondContact OD1-OG1 3.38Å; D51-F54 HydrophobicContact CB-CD2 4.28Å; D51-F54 PolarHBondContact O-N 2.95Å; D51-F54 VanDerWaalsContact O-N 3.16Å; D51-F54 VanDerWaalsContact OD2-CD2 3.23Å; D51-F54 WeakPolarHBondContact OD2-CD2 3.15Å; D51-F54 WeakPolarHBondContact OD2-CE2 3.42Å; D51-M55 PolarHBondContact N-SD 3.4Å; D51-M55 VanDerWaalsContact N-SD 3.36Å; D51-M55 WeakPolarHBondContact O-CB 3.23Å; D51-M55 WeakPolarHBondContact O-CG 3.22Å; D51-M55 PolarHBondContact O-N 3.16Å
52	K	91.5	Very high	87.2	Confident	148 Å²	148	53.1 Å²	53.1	64%	0.643	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.7	177.7	-62.9	-178.8	-178.8	178.9	0	113.4	F50 P56	F50-K52 HydrophobicContact CD1-CG 3.96Å; F50-K52 HydrophobicContact CE1-CG 3.84Å; K52-P56 VanDerWaalsContact O-CD 3.29Å; K52-P56 WeakPolarHBondContact O-CD 3.22Å; K52-P56 VanDerWaalsContact O-CG 3.29Å; K52-P56 WeakPolarHBondContact O-CG 3.47Å
53	T	89.1	Confident	86.8	Confident	81 Å²	81	56.7 Å²	56.7	50%	0.497	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-28.3	-179.7	-40.3	0	0	0	0	111.9	D51 K59	D51-T53 PolarHBondContact O-N 3.45Å; D51-T53 VanDerWaalsContact O-N 3.09Å; D51-T53 WeakPolarHBondContact OD1-CA 3.33Å; D51-T53 WeakPolarHBondContact OD1-CB 3.49Å; D51-T53 PolarHBondContact OD1-N 3.33Å; D51-T53 PolarHBondContact OD1-OG1 3.38Å; T53-K59 WeakPolarHBondContact O-CE 3.29Å; T53-K59 WeakPolarHBondContact O-CG 3.34Å
54	F	87.5	Confident	86.6	Confident	49 Å²	49	57.5 Å²	57.5	22%	0.215	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-23.4	-170.1	-50.5	-70.4	0	0	0	115	D51 K59 W64 N65 P144	D51-F54 HydrophobicContact CB-CD2 4.28Å; D51-F54 PolarHBondContact O-N 2.95Å; D51-F54 VanDerWaalsContact O-N 3.16Å; D51-F54 VanDerWaalsContact OD2-CD2 3.23Å; D51-F54 WeakPolarHBondContact OD2-CD2 3.15Å; D51-F54 WeakPolarHBondContact OD2-CE2 3.42Å; F54-K59 VanDerWaalsContact O-CB 3.26Å; F54-K59 WeakPolarHBondContact O-CB 3.47Å; F54-W64 HydrophobicContact CB-CD2 4.12Å; F54-W64 HydrophobicContact CB-CE3 3.53Å; F54-W64 HydrophobicContact CB-CZ3 3.99Å; F54-W64 HydrophobicContact CG-CE3 4.38Å; F54-N65 WeakPolarHBondContact O-CB 3.36Å; F54-N65 PolarHBondContact O-ND2 3.03Å; F54-P144 HydrophobicContact CD1-CB 3.8Å; F54-P144 HydrophobicContact CD1-CG 4.35Å; F54-P144 HydrophobicContact CD2-CB 4Å; F54-P144 HydrophobicContact CD2-CG 3.62Å; F54-P144 HydrophobicContact CE1-CB 3.4Å; F54-P144 VanDerWaalsContact CE1-CB 3.4Å; F54-P144 HydrophobicContact CE1-CG 4.08Å; F54-P144 HydrophobicContact CE2-CB 3.67Å; F54-P144 HydrophobicContact CE2-CG 3.34Å; F54-P144 HydrophobicContact CG-CB 4.09Å; F54-P144 HydrophobicContact CG-CG 4.15Å; F54-P144 HydrophobicContact CZ-CB 3.34Å; F54-P144 HydrophobicContact CZ-CG 3.59Å
55	M	90.2	Very high	86.6	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	29%	0.292	C	S	.	.	S	Bend	trans	-88.8	-31.7	-173.4	-66.1	-175.3	-180	0	0	117	V48 P49 F50 D51 W64 N65 F68 F97 T104	V48-M55 HydrophobicContact CG1-CE 3.84Å; P49-M55 WeakPolarHBondContact O-CE 3.34Å; F50-M55 HydrophobicContact CB-SD 4.42Å; F50-M55 HydrophobicContact CD2-CB 4.12Å; F50-M55 HydrophobicContact CD2-SD 3.58Å; F50-M55 VanDerWaalsContact CD2-SD 3.58Å; F50-M55 HydrophobicContact CE1-CB 4.46Å; F50-M55 HydrophobicContact CE2-CB 3.58Å; F50-M55 HydrophobicContact CE2-CG 4.44Å; F50-M55 HydrophobicContact CE2-SD 4Å; F50-M55 HydrophobicContact CG-SD 4.08Å; F50-M55 HydrophobicContact CZ-CB 3.78Å; D51-M55 PolarHBondContact N-SD 3.4Å; D51-M55 VanDerWaalsContact N-SD 3.36Å; D51-M55 WeakPolarHBondContact O-CB 3.23Å; D51-M55 WeakPolarHBondContact O-CG 3.22Å; D51-M55 PolarHBondContact O-N 3.16Å; M55-W64 HydrophobicContact CE-CH2 3.67Å; M55-W64 HydrophobicContact CE-CZ3 4.13Å; M55-W64 HydrophobicContact CG-CH2 4.43Å; M55-W64 HydrophobicContact CG-CZ3 3.96Å; M55-N65 PolarHBondContact O-ND2 2.9Å; M55-F68 HydrophobicContact CE-CE1 4.09Å; M55-F97 HydrophobicContact CB-CB 4.08Å; M55-F97 HydrophobicContact CB-CD2 4.38Å; M55-F97 HydrophobicContact CB-CG 4.49Å; M55-T104 HydrophobicContact CE-CG2 4.14Å; M55-T104 VanDerWaalsContact CE-OG1 3.27Å; M55-T104 WeakPolarHBondContact CE-OG1 3.44Å; M55-T104 HydrophobicContact SD-CG2 3.68Å; M55-T104 PolarHBondContact SD-OG1 2.79Å
56	P	89	Confident	86.3	Confident	17 Å²	17	59.3 Å²	59.3	11%	0.11	31%	0.308	C	S	.	.	S	Bend	trans	-55.5	161.2	-179.6	-30.4	38.7	0	0	0	114.2	F50 K52 E58 K59	F50-P56 HydrophobicContact CE1-CG 4.36Å; F50-P56 HydrophobicContact CZ-CG 4.23Å; K52-P56 VanDerWaalsContact O-CD 3.29Å; K52-P56 WeakPolarHBondContact O-CD 3.22Å; K52-P56 VanDerWaalsContact O-CG 3.29Å; K52-P56 WeakPolarHBondContact O-CG 3.47Å; P56-E58 VanDerWaalsContact C-N 3.28Å; P56-E58 HydrophobicContact CB-CG 4.34Å; P56-E58 WeakPolarHBondContact CB-OE1 3.34Å; P56-E58 WeakPolarHBondContact CB-OE2 3.36Å; P56-E58 PolarHBondContact O-N 3.07Å; P56-K59 WeakPolarHBondContact O-CA 3.46Å; P56-K59 WeakPolarHBondContact O-CB 3.33Å; P56-K59 PolarHBondContact O-N 3.45Å
57	D	86.2	Confident	86.1	Confident	36 Å²	36	56 Å²	56	19%	0.193	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-64.6	-30.8	-173.8	-77.4	-49.7	0	0	0	113	K59 R60 R69 C96 R98	D57-K59 PolarHBondContact O-N 3.02Å; D57-K59 VanDerWaalsContact O-N 3.1Å; D57-R60 WeakPolarHBondContact O-CB 3.22Å; D57-R60 PolarHBondContact O-N 3.33Å; D57-R60 IonicContact OD1-CZ 3.14Å; D57-R60 IonicContact OD1-NE 2.84Å; D57-R60 IonicContact OD1-NH2 3.3Å; D57-R60 PolarHBondContact OD1-NH2 3.46Å; D57-R69 IonicContact OD1-NH2 3.47Å; D57-C96 WeakPolarHBondContact OD1-CB 3.28Å; D57-R98 IonicContact OD2-CZ 2.7Å; D57-R98 VanDerWaalsContact OD2-CZ 3.24Å; D57-R98 IonicContact OD2-NH1 3.85Å; D57-R98 PolarHBondContact OD2-NH1 3.02Å; D57-R98 IonicContact OD2-NH2 3.84Å; D57-R98 PolarHBondContact OD2-NH2 3.33Å
58	E	86.3	Confident	86.3	Confident	139 Å²	139	54.2 Å²	54.2	65%	0.65	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-63.3	-15.1	172.9	65.7	-88.1	-162.4	0	0	113.5	P56	P56-E58 VanDerWaalsContact C-N 3.28Å; P56-E58 HydrophobicContact CB-CG 4.34Å; P56-E58 WeakPolarHBondContact CB-OE1 3.34Å; P56-E58 WeakPolarHBondContact CB-OE2 3.36Å; P56-E58 PolarHBondContact O-N 3.07Å
59	K	86.1	Confident	86.3	Confident	77 Å²	77	54.9 Å²	54.9	34%	0.335	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-99.6	5.4	176	-53.2	-56.6	-177.8	-171.6	0	113	T53 F54 P56 D57 T61 T62 N65	T53-K59 WeakPolarHBondContact O-CE 3.29Å; T53-K59 WeakPolarHBondContact O-CG 3.34Å; F54-K59 VanDerWaalsContact O-CB 3.26Å; F54-K59 WeakPolarHBondContact O-CB 3.47Å; P56-K59 WeakPolarHBondContact O-CA 3.46Å; P56-K59 WeakPolarHBondContact O-CB 3.33Å; P56-K59 PolarHBondContact O-N 3.45Å; D57-K59 PolarHBondContact O-N 3.02Å; D57-K59 VanDerWaalsContact O-N 3.1Å; K59-T61 PolarHBondContact O-N 3.42Å; K59-T61 VanDerWaalsContact O-N 3.08Å; K59-T62 HydrophobicContact CB-CG2 4.09Å; K59-T62 HydrophobicContact CD-CG2 4.29Å; K59-T62 WeakPolarHBondContact O-CB 3.48Å; K59-T62 WeakPolarHBondContact O-CG2 3.46Å; K59-T62 PolarHBondContact O-N 2.91Å; K59-T62 PolarHBondContact O-OG1 3.26Å; K59-N65 WeakPolarHBondContact O-CB 3.42Å
60	R	83.9	Confident	86	Confident	68 Å²	68	53.4 Å²	53.4	26%	0.257	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.7	-176.3	-175.5	-178.4	-69	179.8	1.9	113.9	D57 I66 R95	D57-R60 WeakPolarHBondContact O-CB 3.22Å; D57-R60 PolarHBondContact O-N 3.33Å; D57-R60 IonicContact OD1-CZ 3.14Å; D57-R60 IonicContact OD1-NE 2.84Å; D57-R60 IonicContact OD1-NH2 3.3Å; D57-R60 PolarHBondContact OD1-NH2 3.46Å; R60-I66 WeakPolarHBondContact O-CG1 3.47Å; R60-R95 PolarHBondContact NH2-O 3.46Å
61	T	78.6	Confident	85.6	Confident	123 Å²	123	51.8 Å²	51.8	76%	0.755	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.8	178.4	55.9	0	0	0	0	113.8	K59	K59-T61 PolarHBondContact O-N 3.42Å; K59-T61 VanDerWaalsContact O-N 3.08Å
62	T	78.1	Confident	85.4	Confident	45 Å²	45	49 Å²	49	28%	0.276	24%	0.242	S	C	.	.	S	Bend	trans	-73.6	144.4	177.3	67.4	0	0	0	0	110.9	K59 W64 N65 I66	K59-T62 HydrophobicContact CB-CG2 4.09Å; K59-T62 HydrophobicContact CD-CG2 4.29Å; K59-T62 WeakPolarHBondContact O-CB 3.48Å; K59-T62 WeakPolarHBondContact O-CG2 3.46Å; K59-T62 PolarHBondContact O-N 2.91Å; K59-T62 PolarHBondContact O-OG1 3.26Å; T62-W64 VanDerWaalsContact C-N 3.3Å; T62-W64 PolarHBondContact O-N 3.18Å; T62-N65 PolarHBondContact O-N 3.29Å; T62-N65 VanDerWaalsContact O-N 3.16Å; T62-N65 VanDerWaalsContact OG1-CB 3.26Å; T62-N65 WeakPolarHBondContact OG1-CB 3.36Å; T62-N65 PolarHBondContact OG1-N 3.48Å; T62-I66 WeakPolarHBondContact O-CG1 3.32Å; T62-I66 PolarHBondContact O-N 3.38Å
63	M	78.8	Confident	85.2	Confident	84 Å²	84	42.8 Å²	42.8	41%	0.414	22%	0.215	S	C	.	.	H	α-helix	trans	-58.1	-41.4	-177.5	-71.2	-161.4	-58.9	0	0	112.9	I66 G67 V147 Y149 V152	M63-I66 PolarHBondContact O-N 3.39Å; M63-G67 PolarHBondContact O-N 3.45Å; M63-V147 HydrophobicContact CB-CG1 4.33Å; M63-V147 WeakPolarHBondContact CE-O 3.33Å; M63-Y149 HydrophobicContact SD-CD2 4.49Å; M63-V152 HydrophobicContact CB-CG2 4.46Å; M63-V152 WeakPolarHBondContact O-CG2 3.46Å
64	W	84.7	Confident	84.8	Confident	16 Å²	16	39.4 Å²	39.4	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-46	178.1	-170.3	91.6	0	0	0	111.3	F54 M55 T62 I66 G67 F68 F139 S142 P144 V147	F54-W64 HydrophobicContact CB-CD2 4.12Å; F54-W64 HydrophobicContact CB-CE3 3.53Å; F54-W64 HydrophobicContact CB-CZ3 3.99Å; F54-W64 HydrophobicContact CG-CE3 4.38Å; M55-W64 HydrophobicContact CE-CH2 3.67Å; M55-W64 HydrophobicContact CE-CZ3 4.13Å; M55-W64 HydrophobicContact CG-CH2 4.43Å; M55-W64 HydrophobicContact CG-CZ3 3.96Å; T62-W64 VanDerWaalsContact C-N 3.3Å; T62-W64 PolarHBondContact O-N 3.18Å; W64-I66 PolarHBondContact O-N 3.48Å; W64-G67 PolarHBondContact O-N 2.78Å; W64-F68 HydrophobicContact CE3-CB 4.12Å; W64-F68 HydrophobicContact CH2-CB 4.06Å; W64-F68 AromaticContact CH2-CD1 3.88Å; W64-F68 HydrophobicContact CH2-CD1 3.88Å; W64-F68 HydrophobicContact CH2-CD2 4.19Å; W64-F68 HydrophobicContact CH2-CE1 4.4Å; W64-F68 AromaticContact CH2-CG 3.77Å; W64-F68 HydrophobicContact CH2-CG 3.77Å; W64-F68 HydrophobicContact CZ2-CD2 4.49Å; W64-F68 HydrophobicContact CZ2-CG 4.39Å; W64-F68 HydrophobicContact CZ3-CB 3.84Å; W64-F68 AromaticContact CZ3-CD1 3.9Å; W64-F68 HydrophobicContact CZ3-CD1 3.9Å; W64-F68 AromaticContact CZ3-CG 3.93Å; W64-F68 HydrophobicContact CZ3-CG 3.93Å; W64-F68 WeakPolarHBondContact O-CB 3.26Å; W64-F68 PolarHBondContact O-N 2.97Å; W64-F139 AromaticContact CD1-CE1 3.82Å; W64-F139 HydrophobicContact CD2-CE1 4.22Å; W64-F139 HydrophobicContact CG-CE1 4.12Å; W64-F139 AromaticContact NE1-CE1 3.82Å; W64-F139 WeakPolarHBondContact O-CE1 3.41Å; W64-S142 PolarHBondContact NE1-O 3.05Å; W64-P144 HydrophobicContact CB-CB 4.3Å; W64-P144 VanDerWaalsContact CD1-CA 3.44Å; W64-P144 HydrophobicContact CG-CB 3.99Å; W64-P144 HydrophobicContact CG-CG 4.23Å; W64-V147 HydrophobicContact CG-CG2 4.43Å
65	N	87.8	Confident	84.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-44.7	178.5	-168.2	-65.9	0	0	0	111.4	F54 M55 K59 T62 F68 R69	F54-N65 WeakPolarHBondContact O-CB 3.36Å; F54-N65 PolarHBondContact O-ND2 3.03Å; M55-N65 PolarHBondContact O-ND2 2.9Å; K59-N65 WeakPolarHBondContact O-CB 3.42Å; T62-N65 PolarHBondContact O-N 3.29Å; T62-N65 VanDerWaalsContact O-N 3.16Å; T62-N65 VanDerWaalsContact OG1-CB 3.26Å; T62-N65 WeakPolarHBondContact OG1-CB 3.36Å; T62-N65 PolarHBondContact OG1-N 3.48Å; N65-F68 PolarHBondContact O-N 3.19Å; N65-R69 VanDerWaalsContact O-CG 3.27Å; N65-R69 WeakPolarHBondContact O-CG 3.23Å; N65-R69 PolarHBondContact O-N 3.26Å; N65-R69 WeakPolarHBondContact OD1-CD 3.09Å; N65-R69 PolarHBondContact OD1-NE 2.91Å
66	I	81.3	Confident	84.5	Confident	63 Å²	63	37.1 Å²	37.1	32%	0.323	18%	0.184	S	C	.	.	H	α-helix	trans	-59.8	-49.7	176.4	-63.9	168.2	0	0	0	110.3	R60 T62 M63 W64 F68 R69 K70 V152	R60-I66 WeakPolarHBondContact O-CG1 3.47Å; T62-I66 WeakPolarHBondContact O-CG1 3.32Å; T62-I66 PolarHBondContact O-N 3.38Å; M63-I66 PolarHBondContact O-N 3.39Å; W64-I66 PolarHBondContact O-N 3.48Å; I66-F68 VanDerWaalsContact C-N 3.35Å; I66-F68 PolarHBondContact O-N 3.49Å; I66-R69 WeakPolarHBondContact O-CB 3.28Å; I66-R69 PolarHBondContact O-N 3.04Å; I66-K70 WeakPolarHBondContact O-CG 3.29Å; I66-K70 PolarHBondContact O-N 2.85Å; I66-V152 HydrophobicContact CB-CG1 4.32Å; I66-V152 HydrophobicContact CG2-CG1 3.61Å
67	G	81.1	Confident	84.1	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.1	-43.4	178.8	0	0	0	0	0	112.5	M63 W64 R69 K70 S71 F139	M63-G67 PolarHBondContact O-N 3.45Å; W64-G67 PolarHBondContact O-N 2.78Å; G67-R69 PolarHBondContact O-N 3.3Å; G67-K70 CarbonylContact O-C 3.58Å; G67-K70 WeakPolarHBondContact O-CA 3.44Å; G67-K70 WeakPolarHBondContact O-CB 3.29Å; G67-K70 PolarHBondContact O-N 2.76Å; G67-K70 VanDerWaalsContact O-N 3.1Å; G67-S71 PolarHBondContact O-N 3.17Å; G67-S71 PolarHBondContact O-OG 3.19Å; G67-F139 VanDerWaalsContact CA-CZ 3.46Å
68	F	88.5	Confident	83.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.4	-37.4	177.7	-170.3	-121.3	0	0	0	112.3	L45 V48 M55 W64 N65 I66 K70 S71 V72 F97 T104 Y136 F139	L45-F68 HydrophobicContact CD1-CE1 4.33Å; L45-F68 HydrophobicContact CD1-CZ 3.78Å; V48-F68 HydrophobicContact CG1-CZ 3.94Å; M55-F68 HydrophobicContact CE-CE1 4.09Å; W64-F68 HydrophobicContact CE3-CB 4.12Å; W64-F68 HydrophobicContact CH2-CB 4.06Å; W64-F68 AromaticContact CH2-CD1 3.88Å; W64-F68 HydrophobicContact CH2-CD1 3.88Å; W64-F68 HydrophobicContact CH2-CD2 4.19Å; W64-F68 HydrophobicContact CH2-CE1 4.4Å; W64-F68 AromaticContact CH2-CG 3.77Å; W64-F68 HydrophobicContact CH2-CG 3.77Å; W64-F68 HydrophobicContact CZ2-CD2 4.49Å; W64-F68 HydrophobicContact CZ2-CG 4.39Å; W64-F68 HydrophobicContact CZ3-CB 3.84Å; W64-F68 AromaticContact CZ3-CD1 3.9Å; W64-F68 HydrophobicContact CZ3-CD1 3.9Å; W64-F68 AromaticContact CZ3-CG 3.93Å; W64-F68 HydrophobicContact CZ3-CG 3.93Å; W64-F68 WeakPolarHBondContact O-CB 3.26Å; W64-F68 PolarHBondContact O-N 2.97Å; N65-F68 PolarHBondContact O-N 3.19Å; I66-F68 VanDerWaalsContact C-N 3.35Å; I66-F68 PolarHBondContact O-N 3.49Å; F68-K70 VanDerWaalsContact C-N 3.3Å; F68-K70 PolarHBondContact O-N 3.26Å; F68-S71 VanDerWaalsContact CA-OG 3.3Å; F68-S71 WeakPolarHBondContact CA-OG 3.38Å; F68-S71 PolarHBondContact O-N 3.17Å; F68-S71 PolarHBondContact O-OG 3.4Å; F68-V72 HydrophobicContact CE1-CG2 4.47Å; F68-V72 HydrophobicContact CE2-CG2 4.48Å; F68-V72 HydrophobicContact CZ-CG2 4.31Å; F68-V72 WeakPolarHBondContact O-CG2 3.38Å; F68-V72 PolarHBondContact O-N 3.34Å; F68-F97 AromaticContact CD1-CE1 3.71Å; F68-F97 HydrophobicContact CD1-CE1 3.71Å; F68-F97 HydrophobicContact CD1-CE2 4.01Å; F68-F97 AromaticContact CD1-CZ 3.4Å; F68-F97 HydrophobicContact CD1-CZ 3.4Å; F68-F97 VanDerWaalsContact CD1-CZ 3.4Å; F68-F97 HydrophobicContact CE1-CD1 4.23Å; F68-F97 AromaticContact CE1-CE1 3.63Å; F68-F97 HydrophobicContact CE1-CE1 3.63Å; F68-F97 AromaticContact CE1-CZ 3.86Å; F68-F97 HydrophobicContact CE1-CZ 3.86Å; F68-F97 HydrophobicContact CG-CZ 4.4Å; F68-T104 HydrophobicContact CE1-CG2 4.27Å; F68-Y136 HydrophobicContact CE2-CD2 4.21Å; F68-Y136 WeakPolarHBondContact CE2-O 3.47Å; F68-Y136 HydrophobicContact CZ-CD2 4.49Å; F68-F139 HydrophobicContact CB-CD1 3.86Å; F68-F139 HydrophobicContact CB-CE1 3.85Å; F68-F139 AromaticContact CD2-CD1 3.95Å; F68-F139 HydrophobicContact CD2-CD1 3.95Å; F68-F139 HydrophobicContact CG-CD1 4.39Å; F68-F139 VanDerWaalsContact N-CE1 3.3Å
69	R	89.4	Confident	83.7	Confident	19 Å²	19	30.9 Å²	30.9	7%	0.072	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-41.4	171.2	-71.3	179	-174.6	-105.1	-3.3	111.5	D57 N65 I66 G67 V72 Q73 V94 R95 F97	D57-R69 IonicContact OD1-NH2 3.47Å; N65-R69 VanDerWaalsContact O-CG 3.27Å; N65-R69 WeakPolarHBondContact O-CG 3.23Å; N65-R69 PolarHBondContact O-N 3.26Å; N65-R69 WeakPolarHBondContact OD1-CD 3.09Å; N65-R69 PolarHBondContact OD1-NE 2.91Å; I66-R69 WeakPolarHBondContact O-CB 3.28Å; I66-R69 PolarHBondContact O-N 3.04Å; G67-R69 PolarHBondContact O-N 3.3Å; R69-V72 PolarHBondContact O-N 3.42Å; R69-Q73 VanDerWaalsContact O-CG 3.27Å; R69-Q73 WeakPolarHBondContact O-CG 3.3Å; R69-Q73 PolarHBondContact O-N 3.37Å; R69-V94 HydrophobicContact CB-CB 4Å; R69-V94 HydrophobicContact CB-CG2 4.13Å; R69-V94 HydrophobicContact CG-CB 3.77Å; R69-V94 HydrophobicContact CG-CG1 3.84Å; R69-V94 HydrophobicContact CG-CG2 4.3Å; R69-V94 PolarHBondContact NH1-O 3.19Å; R69-R95 PolarHBondContact NH1-O 3.48Å; R69-F97 HydrophobicContact CB-CZ 4.5Å; R69-F97 HydrophobicContact CG-CE2 3.56Å; R69-F97 HydrophobicContact CG-CZ 3.56Å
70	K	84	Confident	83.5	Confident	61 Å²	61	27.2 Å²	27.2	27%	0.265	13%	0.134	S	C	.	.	H	α-helix	trans	-67.1	-41.9	177.9	-68.1	-67	176.4	-171.6	0	111.8	I66 G67 F68 V72 Q73 H74 H155 S156 I159	I66-K70 WeakPolarHBondContact O-CG 3.29Å; I66-K70 PolarHBondContact O-N 2.85Å; G67-K70 CarbonylContact O-C 3.58Å; G67-K70 WeakPolarHBondContact O-CA 3.44Å; G67-K70 WeakPolarHBondContact O-CB 3.29Å; G67-K70 PolarHBondContact O-N 2.76Å; G67-K70 VanDerWaalsContact O-N 3.1Å; F68-K70 VanDerWaalsContact C-N 3.3Å; F68-K70 PolarHBondContact O-N 3.26Å; K70-V72 VanDerWaalsContact C-N 3.33Å; K70-V72 PolarHBondContact O-N 2.84Å; K70-Q73 VanDerWaalsContact CD-OE1 3.31Å; K70-Q73 VanDerWaalsContact NZ-OE1 3.12Å; K70-Q73 WeakPolarHBondContact O-CB 3.46Å; K70-Q73 PolarHBondContact O-N 3.45Å; K70-H74 WeakPolarHBondContact O-CB 3.42Å; K70-H74 PolarHBondContact O-N 3.48Å; K70-H155 HydrophobicContact CB-CB 3.84Å; K70-S156 VanDerWaalsContact CD-OG 3.28Å; K70-S156 WeakPolarHBondContact CD-OG 3.43Å; K70-S156 WeakPolarHBondContact CE-OG 3.4Å; K70-S156 WeakPolarHBondContact CG-OG 3.33Å; K70-I159 HydrophobicContact CD-CD1 4.27Å; K70-I159 WeakPolarHBondContact O-CD1 3.09Å
71	S	84.1	Confident	83.2	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-38.9	176.8	63.9	0	0	0	0	112.3	G67 F68 H74 D75 Y136	G67-S71 PolarHBondContact O-N 3.17Å; G67-S71 PolarHBondContact O-OG 3.19Å; F68-S71 VanDerWaalsContact CA-OG 3.3Å; F68-S71 WeakPolarHBondContact CA-OG 3.38Å; F68-S71 PolarHBondContact O-N 3.17Å; F68-S71 PolarHBondContact O-OG 3.4Å; S71-H74 WeakPolarHBondContact O-CB 3.02Å; S71-H74 PolarHBondContact O-N 3.39Å; S71-D75 PolarHBondContact O-N 3.16Å; S71-Y136 WeakPolarHBondContact OG-CA 3.42Å
72	V	88	Confident	83.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.7	-42.1	172	176.1	0	0	0	0	111.7	L45 F68 R69 K70 H74 D75 V76 V94 V106 L108 L126 Y136	L45-V72 HydrophobicContact CD1-CG2 4.41Å; F68-V72 HydrophobicContact CE1-CG2 4.47Å; F68-V72 HydrophobicContact CE2-CG2 4.48Å; F68-V72 HydrophobicContact CZ-CG2 4.31Å; F68-V72 WeakPolarHBondContact O-CG2 3.38Å; F68-V72 PolarHBondContact O-N 3.34Å; R69-V72 PolarHBondContact O-N 3.42Å; K70-V72 VanDerWaalsContact C-N 3.33Å; K70-V72 PolarHBondContact O-N 2.84Å; V72-H74 VanDerWaalsContact C-N 3.26Å; V72-H74 PolarHBondContact O-N 2.96Å; V72-D75 PolarHBondContact O-N 2.71Å; V72-V76 WeakPolarHBondContact O-CG2 3.33Å; V72-V76 PolarHBondContact O-N 2.83Å; V72-V94 HydrophobicContact CB-CG2 3.99Å; V72-V94 HydrophobicContact CG1-CG2 3.97Å; V72-V106 HydrophobicContact CG1-CG1 4.39Å; V72-V106 HydrophobicContact CG1-CG2 4.16Å; V72-L108 HydrophobicContact CG1-CD1 4.49Å; V72-L108 HydrophobicContact CG1-CD2 3.86Å; V72-L126 HydrophobicContact CG1-CD2 4.4Å; V72-Y136 HydrophobicContact CG2-CD1 4.49Å; V72-Y136 HydrophobicContact CG2-CG 4.24Å
73	Q	86.5	Confident	83.2	Confident	18 Å²	18	25 Å²	25	8%	0.084	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-38.9	175.6	-74.4	171.5	-1.6	0	0	112.2	R69 K70 V76 L77 S92 V94 I159	R69-Q73 VanDerWaalsContact O-CG 3.27Å; R69-Q73 WeakPolarHBondContact O-CG 3.3Å; R69-Q73 PolarHBondContact O-N 3.37Å; K70-Q73 VanDerWaalsContact CD-OE1 3.31Å; K70-Q73 VanDerWaalsContact NZ-OE1 3.12Å; K70-Q73 WeakPolarHBondContact O-CB 3.46Å; K70-Q73 PolarHBondContact O-N 3.45Å; Q73-V76 WeakPolarHBondContact O-CB 3.37Å; Q73-V76 PolarHBondContact O-N 3.46Å; Q73-L77 PolarHBondContact O-N 3.09Å; Q73-L77 VanDerWaalsContact O-N 3.12Å; Q73-S92 WeakPolarHBondContact CA-OG 3.27Å; Q73-S92 WeakPolarHBondContact CB-OG 3.49Å; Q73-S92 WeakPolarHBondContact CG-O 3.48Å; Q73-S92 PolarHBondContact NE2-O 3.19Å; Q73-S92 PolarHBondContact O-OG 3.19Å; Q73-V94 HydrophobicContact CG-CG2 4.35Å; Q73-I159 HydrophobicContact CB-CD1 3.71Å
74	H	80.9	Confident	83.1	Confident	11 Å²	11	22.6 Å²	22.6	5%	0.051	11%	0.113	C	C	.	.	H	α-helix	trans	-63.9	-45.2	176.2	-174.2	-169.6	0	0	0	111	K70 S71 V72 V76 L77 R78 P135 I158 I159 L162	K70-H74 WeakPolarHBondContact O-CB 3.42Å; K70-H74 PolarHBondContact O-N 3.48Å; S71-H74 WeakPolarHBondContact O-CB 3.02Å; S71-H74 PolarHBondContact O-N 3.39Å; V72-H74 VanDerWaalsContact C-N 3.26Å; V72-H74 PolarHBondContact O-N 2.96Å; H74-V76 VanDerWaalsContact C-N 3.32Å; H74-V76 PolarHBondContact O-N 2.84Å; H74-L77 PolarHBondContact O-N 3.3Å; H74-L77 VanDerWaalsContact O-N 3.16Å; H74-R78 WeakPolarHBondContact O-CB 3.04Å; H74-R78 PolarHBondContact O-N 3.47Å; H74-P135 HydrophobicContact CB-CB 4.24Å; H74-P135 HydrophobicContact CB-CG 4.27Å; H74-P135 WeakPolarHBondContact ND1-CG 3.18Å; H74-I158 WeakPolarHBondContact CE1-CG2 3.45Å; H74-I158 WeakPolarHBondContact NE2-CG2 3.35Å; H74-I159 HydrophobicContact CB-CD1 4.09Å; H74-I159 HydrophobicContact CB-CG1 3.83Å; H74-L162 WeakPolarHBondContact NE2-CD1 3.21Å
75	D	84.7	Confident	82.8	Confident	2 Å²	2	22 Å²	22	1%	0.011	11%	0.111	C	C	.	.	H	α-helix	trans	-61.4	-38.4	175	-87.3	-49.3	0	0	0	112.9	S71 V72 L77 R78 M79 G134 P135 Y136	S71-D75 PolarHBondContact O-N 3.16Å; V72-D75 PolarHBondContact O-N 2.71Å; D75-L77 VanDerWaalsContact C-N 3.34Å; D75-L77 PolarHBondContact O-N 2.79Å; D75-R78 PolarHBondContact O-N 3.21Å; D75-M79 WeakPolarHBondContact O-CB 3.11Å; D75-M79 VanDerWaalsContact O-CG 3.27Å; D75-M79 WeakPolarHBondContact O-CG 3.43Å; D75-M79 PolarHBondContact O-N 3.32Å; D75-G134 VanDerWaalsContact OD1-CA 3.25Å; D75-G134 WeakPolarHBondContact OD1-CA 3.01Å; D75-P135 WeakPolarHBondContact OD1-CD 3.34Å; D75-Y136 HydrophobicContact CB-CD1 4.08Å; D75-Y136 WeakPolarHBondContact OD2-CD1 2.75Å; D75-Y136 PolarHBondContact OD2-N 3.4Å
76	V	85.5	Confident	82.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.3	-47.5	173.1	171.9	0	0	0	0	111.1	V72 Q73 H74 M79 M80 Y89 L108 V110 V122 L126	V72-V76 WeakPolarHBondContact O-CG2 3.33Å; V72-V76 PolarHBondContact O-N 2.83Å; Q73-V76 WeakPolarHBondContact O-CB 3.37Å; Q73-V76 PolarHBondContact O-N 3.46Å; H74-V76 VanDerWaalsContact C-N 3.32Å; H74-V76 PolarHBondContact O-N 2.84Å; V76-M79 PolarHBondContact O-N 3.16Å; V76-M80 HydrophobicContact CG1-SD 4.45Å; V76-M80 WeakPolarHBondContact O-CG 3.5Å; V76-M80 PolarHBondContact O-N 2.8Å; V76-Y89 HydrophobicContact CG1-CE2 4.41Å; V76-L108 HydrophobicContact CG2-CD1 4.19Å; V76-L108 HydrophobicContact CG2-CD2 4.37Å; V76-V110 HydrophobicContact CG1-CG1 4.31Å; V76-V110 HydrophobicContact CG1-CG2 4.01Å; V76-V122 HydrophobicContact CG1-CG1 4.28Å; V76-L126 HydrophobicContact CG2-CD1 3.72Å
77	L	82.5	Confident	81.7	Confident	3 Å²	3	24.2 Å²	24.2	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-63.7	-47.4	178.8	174.2	54.5	0	0	0	111.1	Q73 H74 D75 M79 M80 I81 Y89 I159 L162 Q163	Q73-L77 PolarHBondContact O-N 3.09Å; Q73-L77 VanDerWaalsContact O-N 3.12Å; H74-L77 PolarHBondContact O-N 3.3Å; H74-L77 VanDerWaalsContact O-N 3.16Å; D75-L77 VanDerWaalsContact C-N 3.34Å; D75-L77 PolarHBondContact O-N 2.79Å; L77-M79 VanDerWaalsContact C-N 3.31Å; L77-M79 PolarHBondContact O-N 3.04Å; L77-M80 PolarHBondContact O-N 3.21Å; L77-M80 VanDerWaalsContact O-N 3.12Å; L77-I81 HydrophobicContact CD1-CD1 4.02Å; L77-I81 HydrophobicContact CD1-CG1 4.18Å; L77-I81 HydrophobicContact CG-CD1 3.96Å; L77-I81 WeakPolarHBondContact O-CG1 3.12Å; L77-I81 PolarHBondContact O-N 3.34Å; L77-Y89 HydrophobicContact CB-CE1 4.39Å; L77-Y89 HydrophobicContact CD1-CD1 3.55Å; L77-Y89 HydrophobicContact CD1-CE1 3.83Å; L77-Y89 HydrophobicContact CD1-CG 3.88Å; L77-Y89 HydrophobicContact CD2-CE1 4.22Å; L77-Y89 HydrophobicContact CG-CE1 4.38Å; L77-I159 HydrophobicContact CD2-CG2 4.23Å; L77-L162 HydrophobicContact CD2-CB 3.54Å; L77-L162 HydrophobicContact CD2-CD1 4.1Å; L77-L162 HydrophobicContact CD2-CG 4.49Å; L77-L162 HydrophobicContact CG-CB 4.41Å; L77-Q163 HydrophobicContact CD2-CG 4.22Å
78	R	80.2	Confident	81.6	Confident	51 Å²	51	28.5 Å²	28.5	19%	0.192	14%	0.14	C	C	.	.	H	α-helix	trans	-55.2	-47.7	177	-178.6	-175.4	163.9	-175.1	4.2	111.2	H74 D75 M80 I81 E82 M133	H74-R78 WeakPolarHBondContact O-CB 3.04Å; H74-R78 PolarHBondContact O-N 3.47Å; D75-R78 PolarHBondContact O-N 3.21Å; R78-M80 PolarHBondContact O-N 3.36Å; R78-I81 WeakPolarHBondContact O-CB 3.46Å; R78-I81 PolarHBondContact O-N 3.15Å; R78-I81 VanDerWaalsContact O-N 3.16Å; R78-E82 IonicContact CZ-OE1 2.92Å; R78-E82 IonicContact NE-OE1 3.93Å; R78-E82 PolarHBondContact NE-OE1 3.4Å; R78-E82 IonicContact NH2-OE1 3.98Å; R78-E82 PolarHBondContact NH2-OE1 3.49Å; R78-E82 WeakPolarHBondContact O-CG 3.43Å; R78-E82 PolarHBondContact O-N 3.45Å; R78-M133 PolarHBondContact NH1-O 3.05Å
79	M	82.4	Confident	81.2	Confident	7 Å²	7	29.6 Å²	29.6	3%	0.034	15%	0.145	C	C	.	.	H	α-helix	trans	-59.8	-47.9	176.7	-73.6	176.1	176.9	0	0	110.9	D75 V76 L77 I81 E82 I83 V122 A125 L126 V130 A131	D75-M79 WeakPolarHBondContact O-CB 3.11Å; D75-M79 VanDerWaalsContact O-CG 3.27Å; D75-M79 WeakPolarHBondContact O-CG 3.43Å; D75-M79 PolarHBondContact O-N 3.32Å; V76-M79 PolarHBondContact O-N 3.16Å; L77-M79 VanDerWaalsContact C-N 3.31Å; L77-M79 PolarHBondContact O-N 3.04Å; M79-I81 PolarHBondContact O-N 3.09Å; M79-E82 PolarHBondContact O-N 2.89Å; M79-I83 WeakPolarHBondContact O-CG1 3.17Å; M79-I83 PolarHBondContact O-N 2.89Å; M79-V122 HydrophobicContact CB-CG1 4.38Å; M79-A125 HydrophobicContact CE-CB 3.75Å; M79-A125 WeakPolarHBondContact CE-O 3.47Å; M79-A125 HydrophobicContact CG-CB 4.12Å; M79-A125 HydrophobicContact SD-CB 3.51Å; M79-A125 VanDerWaalsContact SD-CB 3.51Å; M79-L126 HydrophobicContact CE-CB 4.47Å; M79-L126 HydrophobicContact CE-CG 4.14Å; M79-L126 HydrophobicContact SD-CB 4.19Å; M79-L126 HydrophobicContact SD-CD1 3.99Å; M79-L126 HydrophobicContact SD-CG 3.73Å; M79-L126 PolarHBondContact SD-N 2.89Å; M79-V130 HydrophobicContact CE-CB 4.47Å; M79-A131 HydrophobicContact CE-CB 4.41Å
80	M	82.1	Confident	80.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-35.1	177	-74.2	-173.4	71.6	0	0	113	V76 L77 R78 G84 M85 C86 Y89 V110 A112 M119 V122	V76-M80 HydrophobicContact CG1-SD 4.45Å; V76-M80 WeakPolarHBondContact O-CG 3.5Å; V76-M80 PolarHBondContact O-N 2.8Å; L77-M80 PolarHBondContact O-N 3.21Å; L77-M80 VanDerWaalsContact O-N 3.12Å; R78-M80 PolarHBondContact O-N 3.36Å; M80-G84 PolarHBondContact O-N 3.15Å; M80-M85 HydrophobicContact CB-CB 4.37Å; M80-M85 HydrophobicContact CE-CB 4.13Å; M80-M85 HydrophobicContact CE-CE 3.51Å; M80-M85 HydrophobicContact CG-CE 4.39Å; M80-M85 CarbonylContact O-C 3.48Å; M80-M85 WeakPolarHBondContact O-CA 3.44Å; M80-M85 WeakPolarHBondContact O-CB 3.28Å; M80-M85 PolarHBondContact O-N 3.45Å; M80-C86 PolarHBondContact O-N 3.05Å; M80-Y89 HydrophobicContact CE-CD2 4.2Å; M80-Y89 HydrophobicContact SD-CD2 3.49Å; M80-Y89 WeakPolarHBondContact SD-CD2 3.27Å; M80-Y89 HydrophobicContact SD-CE2 4.35Å; M80-Y89 HydrophobicContact SD-CG 4.23Å; M80-V110 HydrophobicContact SD-CG1 4.16Å; M80-A112 HydrophobicContact CE-CB 3.56Å; M80-M119 HydrophobicContact CE-SD 4.49Å; M80-V122 HydrophobicContact CG-CG2 3.76Å
81	I	78.3	Confident	80.5	Confident	14 Å²	14	32.1 Å²	32.1	7%	0.072	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-48.1	172.4	-64.4	159.3	0	0	0	110.6	L77 R78 M79 I83 G84 C86 L162 L166 L176	L77-I81 HydrophobicContact CD1-CD1 4.02Å; L77-I81 HydrophobicContact CD1-CG1 4.18Å; L77-I81 HydrophobicContact CG-CD1 3.96Å; L77-I81 WeakPolarHBondContact O-CG1 3.12Å; L77-I81 PolarHBondContact O-N 3.34Å; R78-I81 WeakPolarHBondContact O-CB 3.46Å; R78-I81 PolarHBondContact O-N 3.15Å; R78-I81 VanDerWaalsContact O-N 3.16Å; M79-I81 PolarHBondContact O-N 3.09Å; I81-I83 VanDerWaalsContact C-N 3.27Å; I81-I83 PolarHBondContact O-N 3.06Å; I81-G84 PolarHBondContact O-N 3.34Å; I81-C86 HydrophobicContact CG1-CB 4.01Å; I81-L162 HydrophobicContact CD1-CD2 4.32Å; I81-L166 HydrophobicContact CD1-CD1 3.27Å; I81-L166 HydrophobicContact CG1-CD1 3.81Å; I81-L176 HydrophobicContact CD1-CD2 4.32Å; I81-L176 HydrophobicContact CG2-CD2 4.14Å
82	E	76.7	Confident	80.5	Confident	103 Å²	103	32.5 Å²	32.5	48%	0.481	16%	0.159	S	C	.	.	H	α-helix	trans	-60.8	-32.1	-178	-73	174.7	-178.4	0	0	113.3	R78 M79 G84	R78-E82 IonicContact CZ-OE1 2.92Å; R78-E82 IonicContact NE-OE1 3.93Å; R78-E82 PolarHBondContact NE-OE1 3.4Å; R78-E82 IonicContact NH2-OE1 3.98Å; R78-E82 PolarHBondContact NH2-OE1 3.49Å; R78-E82 WeakPolarHBondContact O-CG 3.43Å; R78-E82 PolarHBondContact O-N 3.45Å; M79-E82 PolarHBondContact O-N 2.89Å; E82-G84 VanDerWaalsContact C-N 3.34Å
83	I	79.1	Confident	80.3	Confident	74 Å²	74	37.1 Å²	37.1	38%	0.379	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	12.2	173.1	30.1	161.3	0	0	0	113.8	M79 I81 M85 V122	M79-I83 WeakPolarHBondContact O-CG1 3.17Å; M79-I83 PolarHBondContact O-N 2.89Å; I81-I83 VanDerWaalsContact C-N 3.27Å; I81-I83 PolarHBondContact O-N 3.06Å; I83-M85 HydrophobicContact CD1-SD 3.93Å; I83-M85 PolarHBondContact O-N 2.86Å; I83-V122 HydrophobicContact CD1-CG2 3.51Å
84	G	76.7	Confident	80.3	Confident	33 Å²	33	36.4 Å²	36.4	34%	0.34	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	31.6	174	0	0	0	0	0	114.1	M80 I81 E82	M80-G84 PolarHBondContact O-N 3.15Å; I81-G84 PolarHBondContact O-N 3.34Å; E82-G84 VanDerWaalsContact C-N 3.34Å
85	M	78.1	Confident	80.6	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.02	18%	0.176	C	C	.	.			trans	-117	18.9	180	-67.1	177	29.4	0	0	113.2	M80 I83 D87 R88 Y89 A114 Q118 M119	M80-M85 HydrophobicContact CB-CB 4.37Å; M80-M85 HydrophobicContact CE-CB 4.13Å; M80-M85 HydrophobicContact CE-CE 3.51Å; M80-M85 HydrophobicContact CG-CE 4.39Å; M80-M85 CarbonylContact O-C 3.48Å; M80-M85 WeakPolarHBondContact O-CA 3.44Å; M80-M85 WeakPolarHBondContact O-CB 3.28Å; M80-M85 PolarHBondContact O-N 3.45Å; I83-M85 HydrophobicContact CD1-SD 3.93Å; I83-M85 PolarHBondContact O-N 2.86Å; M85-D87 PolarHBondContact O-N 3.14Å; M85-R88 HydrophobicContact CB-CB 4.49Å; M85-R88 WeakPolarHBondContact O-CB 3.45Å; M85-R88 PolarHBondContact O-N 2.81Å; M85-R88 VanDerWaalsContact O-N 3.13Å; M85-Y89 PolarHBondContact O-N 2.98Å; M85-A114 HydrophobicContact CE-CB 3.66Å; M85-Q118 HydrophobicContact CE-CB 4.07Å; M85-Q118 HydrophobicContact SD-CB 3.55Å; M85-Q118 VanDerWaalsContact SD-CB 3.55Å; M85-Q118 HydrophobicContact SD-CG 3.72Å; M85-M119 HydrophobicContact CE-SD 3.98Å
86	C	75	Confident	80.8	Confident	7 Å²	7	36.5 Å²	36.5	5%	0.047	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-49.6	-52	177	158.8	0	0	0	0	113.4	M80 I81 R88 Y89 L166 C168	M80-C86 PolarHBondContact O-N 3.05Å; I81-C86 HydrophobicContact CG1-CB 4.01Å; C86-R88 PolarHBondContact O-N 3.16Å; C86-R88 VanDerWaalsContact O-N 3.16Å; C86-Y89 PolarHBondContact O-N 3.47Å; C86-L166 WeakPolarHBondContact SG-CB 3.38Å; C86-L166 PolarHBondContact SG-O 3.35Å; C86-C168 HydrophobicContact CB-CB 4.05Å; C86-C168 WeakPolarHBondContact CB-SG 3.27Å; C86-C168 WeakPolarHBondContact SG-CB 3.12Å; C86-C168 CovalentContact SG-SG 2.05Å; C86-C168 PolarHBondContact SG-SG 2.99Å
87	D	71.8	Confident	81.1	Confident	102 Å²	102	36.5 Å²	36.5	55%	0.545	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-65.7	-16.2	-178.6	65.2	-42.1	0	0	0	113.3	M85 C168	M85-D87 PolarHBondContact O-N 3.14Å; D87-C168 HydrophobicContact CB-CB 4.48Å
88	R	80	Confident	81.6	Confident	89 Å²	89	39 Å²	39	34%	0.336	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-97.2	-13.3	-177.5	-64.6	161.1	-170.3	-140.3	6	112.8	M85 C86 A112 I113	M85-R88 HydrophobicContact CB-CB 4.49Å; M85-R88 WeakPolarHBondContact O-CB 3.45Å; M85-R88 PolarHBondContact O-N 2.81Å; M85-R88 VanDerWaalsContact O-N 3.13Å; C86-R88 PolarHBondContact O-N 3.16Å; C86-R88 VanDerWaalsContact O-N 3.16Å; R88-A112 CarbonylContact O-C 3.6Å; R88-A112 WeakPolarHBondContact O-CA 3.27Å; R88-A112 WeakPolarHBondContact O-CB 3.31Å; R88-I113 HydrophobicContact CB-CB 4.13Å; R88-I113 VanDerWaalsContact CB-O 3.26Å; R88-I113 WeakPolarHBondContact CB-O 3.2Å; R88-I113 WeakPolarHBondContact CD-O 3.45Å; R88-I113 HydrophobicContact CG-CB 4.23Å; R88-I113 VanDerWaalsContact CG-O 3.27Å; R88-I113 WeakPolarHBondContact CG-O 3.3Å; R88-I113 PolarHBondContact O-N 2.91Å
89	Y	80.1	Confident	82.1	Confident	23 Å²	23	39.8 Å²	39.8	9%	0.09	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	133.1	180	175.3	-103	0	0	0	111.4	V76 L77 M80 M85 C86 Y91 S92 V110 Q163	V76-Y89 HydrophobicContact CG1-CE2 4.41Å; L77-Y89 HydrophobicContact CB-CE1 4.39Å; L77-Y89 HydrophobicContact CD1-CD1 3.55Å; L77-Y89 HydrophobicContact CD1-CE1 3.83Å; L77-Y89 HydrophobicContact CD1-CG 3.88Å; L77-Y89 HydrophobicContact CD2-CE1 4.22Å; L77-Y89 HydrophobicContact CG-CE1 4.38Å; M80-Y89 HydrophobicContact CE-CD2 4.2Å; M80-Y89 HydrophobicContact SD-CD2 3.49Å; M80-Y89 WeakPolarHBondContact SD-CD2 3.27Å; M80-Y89 HydrophobicContact SD-CE2 4.35Å; M80-Y89 HydrophobicContact SD-CG 4.23Å; M85-Y89 PolarHBondContact O-N 2.98Å; C86-Y89 PolarHBondContact O-N 3.47Å; Y89-Y91 WeakPolarHBondContact CE2-O 3.31Å; Y89-Y91 VanDerWaalsContact CZ-C 3.42Å; Y89-S92 PolarHBondContact OH-N 2.86Å; Y89-S92 PolarHBondContact OH-OG 3.21Å; Y89-V110 HydrophobicContact CD2-CG1 4.48Å; Y89-V110 HydrophobicContact CE2-CG1 4.46Å; Y89-Q163 HydrophobicContact CD1-CG 3.95Å; Y89-Q163 HydrophobicContact CE1-CG 3.66Å
90	Q	77.2	Confident	82.5	Confident	76 Å²	76	43.3 Å²	43.3	36%	0.355	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-51.1	172.2	-57.5	-157.6	-37.6	0	0	111.9	P36 G111 Q163	P36-Q90 HydrophobicContact CB-CG 4.1Å; P36-Q90 VanDerWaalsContact CB-NE2 3.25Å; P36-Q90 VanDerWaalsContact CG-NE2 3.27Å; Q90-G111 WeakPolarHBondContact CA-O 3.47Å; Q90-G111 WeakPolarHBondContact CB-O 3.4Å; Q90-G111 PolarHBondContact N-O 3.11Å; Q90-Q163 PolarHBondContact O-NE2 2.95Å
91	Y	81	Confident	83	Confident	57 Å²	57	47.6 Å²	47.6	22%	0.224	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	160.7	179.5	70	-89	0	0	0	111.5	R38 Y89 E109 V110 G111	R38-Y91 WeakPolarHBondContact CD-OH 3.5Å; R38-Y91 VanDerWaalsContact CG-OH 3.26Å; R38-Y91 WeakPolarHBondContact CG-OH 3.42Å; Y89-Y91 WeakPolarHBondContact CE2-O 3.31Å; Y89-Y91 VanDerWaalsContact CZ-C 3.42Å; Y91-E109 HydrophobicContact CE2-CG 3.98Å; Y91-E109 WeakPolarHBondContact CE2-OE1 3.32Å; Y91-E109 PolarHBondContact OH-OE1 2.98Å; Y91-V110 CarbonylContact O-C 3.53Å; Y91-V110 WeakPolarHBondContact O-CA 3.21Å; Y91-G111 PolarHBondContact N-O 2.86Å; Y91-G111 PolarHBondContact O-N 2.9Å
92	S	83.6	Confident	83.7	Confident	8 Å²	8	52.7 Å²	52.7	6%	0.056	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.4	164.3	54.2	0	0	0	0	109.3	Q73 Y89 E109	Q73-S92 WeakPolarHBondContact CA-OG 3.27Å; Q73-S92 WeakPolarHBondContact CB-OG 3.49Å; Q73-S92 WeakPolarHBondContact CG-O 3.48Å; Q73-S92 PolarHBondContact NE2-O 3.19Å; Q73-S92 PolarHBondContact O-OG 3.19Å; Y89-S92 PolarHBondContact OH-N 2.86Å; Y89-S92 PolarHBondContact OH-OG 3.21Å; S92-E109 CarbonylContact C-O 3.57Å; S92-E109 WeakPolarHBondContact CA-O 3.27Å
93	K	84.7	Confident	84.3	Confident	97 Å²	97	50.1 Å²	50.1	42%	0.422	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	119.9	-179.9	-171.3	176.7	180	-178.1	0	109.5	R95 L108 E109	K93-R95 PolarHBondContact O-N 3.42Å; K93-L108 WeakPolarHBondContact O-CA 3.16Å; K93-E109 HydrophobicContact CB-CB 4.3Å; K93-E109 PolarHBondContact N-O 3.1Å; K93-E109 PolarHBondContact O-N 3.44Å
94	V	86.4	Confident	84.9	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	121.5	167.6	178.5	0	0	0	0	107.7	R69 V72 Q73 F97 V106 L108	R69-V94 HydrophobicContact CB-CB 4Å; R69-V94 HydrophobicContact CB-CG2 4.13Å; R69-V94 HydrophobicContact CG-CB 3.77Å; R69-V94 HydrophobicContact CG-CG1 3.84Å; R69-V94 HydrophobicContact CG-CG2 4.3Å; R69-V94 PolarHBondContact NH1-O 3.19Å; V72-V94 HydrophobicContact CB-CG2 3.99Å; V72-V94 HydrophobicContact CG1-CG2 3.97Å; Q73-V94 HydrophobicContact CG-CG2 4.35Å; V94-F97 HydrophobicContact CG1-CD1 4.34Å; V94-F97 HydrophobicContact CG1-CE1 3.78Å; V94-F97 HydrophobicContact CG1-CE2 4.24Å; V94-F97 HydrophobicContact CG1-CZ 3.73Å; V94-V106 HydrophobicContact CB-CG2 4.44Å; V94-V106 HydrophobicContact CG1-CG2 3.59Å; V94-V106 HydrophobicContact CG2-CG2 4.06Å; V94-L108 HydrophobicContact CB-CD2 4.41Å; V94-L108 HydrophobicContact CG2-CD2 3.61Å
95	R	86.8	Confident	85.6	Confident	14 Å²	14	46.7 Å²	46.7	5%	0.053	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-54.4	179.4	-61.7	-58.4	-63.6	-159.1	6.3	110.6	R60 R69 K93 W107 E109 F228 C232 Y234	R60-R95 PolarHBondContact NH2-O 3.46Å; R69-R95 PolarHBondContact NH1-O 3.48Å; K93-R95 PolarHBondContact O-N 3.42Å; R95-W107 HydrophobicContact CB-CB 4.42Å; R95-W107 PolarHBondContact N-O 3.41Å; R95-E109 HydrophobicContact CG-CB 4.19Å; R95-E109 IonicContact CZ-OE2 3.66Å; R95-E109 IonicContact NE-OE2 3.62Å; R95-E109 IonicContact NH1-OE2 3.66Å; R95-E109 PolarHBondContact NH1-OE2 3.49Å; R95-F228 HydrophobicContact CB-CZ 4.35Å; R95-F228 HydrophobicContact CG-CE1 3.92Å; R95-F228 HydrophobicContact CG-CZ 3.71Å; R95-C232 HydrophobicContact CB-CB 4.07Å; R95-Y234 VanDerWaalsContact NH2-CE2 3.26Å; R95-Y234 VanDerWaalsContact NH2-CG 3.31Å
96	C	89	Confident	86.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	169.5	175.4	71.3	0	0	0	0	111.5	D57 W107 C232	D57-C96 WeakPolarHBondContact OD1-CB 3.28Å; C96-W107 PolarHBondContact O-N 2.96Å; C96-C232 HydrophobicContact CB-CB 3.77Å; C96-C232 WeakPolarHBondContact CB-SG 3.49Å; C96-C232 PolarHBondContact N-SG 2.99Å; C96-C232 VanDerWaalsContact N-SG 3.43Å; C96-C232 WeakPolarHBondContact SG-CA 3.15Å; C96-C232 WeakPolarHBondContact SG-CB 3.34Å; C96-C232 CovalentContact SG-SG 2.03Å; C96-C232 PolarHBondContact SG-SG 3.37Å
97	F	91.6	Very high	86.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	141.5	169.3	-56.9	-71.8	0	0	0	108.6	F50 M55 F68 R69 V94 T104 K105 V106	F50-F97 HydrophobicContact CE2-CB 3.94Å; M55-F97 HydrophobicContact CB-CB 4.08Å; M55-F97 HydrophobicContact CB-CD2 4.38Å; M55-F97 HydrophobicContact CB-CG 4.49Å; F68-F97 AromaticContact CD1-CE1 3.71Å; F68-F97 HydrophobicContact CD1-CE1 3.71Å; F68-F97 HydrophobicContact CD1-CE2 4.01Å; F68-F97 AromaticContact CD1-CZ 3.4Å; F68-F97 HydrophobicContact CD1-CZ 3.4Å; F68-F97 VanDerWaalsContact CD1-CZ 3.4Å; F68-F97 HydrophobicContact CE1-CD1 4.23Å; F68-F97 AromaticContact CE1-CE1 3.63Å; F68-F97 HydrophobicContact CE1-CE1 3.63Å; F68-F97 AromaticContact CE1-CZ 3.86Å; F68-F97 HydrophobicContact CE1-CZ 3.86Å; F68-F97 HydrophobicContact CG-CZ 4.4Å; R69-F97 HydrophobicContact CB-CZ 4.5Å; R69-F97 HydrophobicContact CG-CE2 3.56Å; R69-F97 HydrophobicContact CG-CZ 3.56Å; V94-F97 HydrophobicContact CG1-CD1 4.34Å; V94-F97 HydrophobicContact CG1-CE1 3.78Å; V94-F97 HydrophobicContact CG1-CE2 4.24Å; V94-F97 HydrophobicContact CG1-CZ 3.73Å; F97-T104 HydrophobicContact CB-CG2 4.28Å; F97-T104 HydrophobicContact CD1-CG2 3.81Å; F97-T104 HydrophobicContact CG-CG2 4.36Å; F97-K105 CarbonylContact C-O 3.48Å; F97-K105 WeakPolarHBondContact CA-O 3.48Å; F97-V106 HydrophobicContact CD1-CB 4.03Å; F97-V106 HydrophobicContact CD1-CG2 3.8Å; F97-V106 HydrophobicContact CE1-CB 4.14Å; F97-V106 HydrophobicContact CE1-CG2 3.58Å
98	R	92	Very high	87.6	Confident	57 Å²	57	41.6 Å²	41.6	22%	0.215	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153.7	175.9	-64.9	-66.8	173.3	-105.2	11	110	F50 D57 K105 E231	F50-R98 VanDerWaalsContact CD2-C 3.45Å; F50-R98 VanDerWaalsContact CD2-O 3.31Å; F50-R98 WeakPolarHBondContact CD2-O 2.93Å; F50-R98 VanDerWaalsContact CE2-C 3.4Å; D57-R98 IonicContact OD2-CZ 2.7Å; D57-R98 VanDerWaalsContact OD2-CZ 3.24Å; D57-R98 IonicContact OD2-NH1 3.85Å; D57-R98 PolarHBondContact OD2-NH1 3.02Å; D57-R98 IonicContact OD2-NH2 3.84Å; D57-R98 PolarHBondContact OD2-NH2 3.33Å; R98-K105 HydrophobicContact CB-CB 4.34Å; R98-K105 PolarHBondContact N-O 2.87Å; R98-K105 PolarHBondContact O-N 3.42Å; R98-E231 PolarHBondContact NE-O 3.3Å; R98-E231 IonicContact NE-OE2 2.98Å; R98-E231 PolarHBondContact NH2-O 3.35Å
99	N	92.6	Very high	87.8	Confident	67 Å²	67	37.8 Å²	37.8	36%	0.358	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	122	169.4	-174.6	1.3	0	0	0	108.3	F50 D102	F50-N99 HydrophobicContact CB-CB 4.12Å; F50-N99 HydrophobicContact CD1-CB 3.75Å; F50-N99 HydrophobicContact CD2-CB 4.26Å; F50-N99 HydrophobicContact CE1-CB 4.2Å; F50-N99 HydrophobicContact CG-CB 3.77Å; N99-D102 PolarHBondContact ND2-OD1 3.18Å; N99-D102 WeakPolarHBondContact OD1-CA 3.42Å; N99-D102 PolarHBondContact OD1-N 2.93Å
100	E	90.3	Very high	87.9	Confident	80 Å²	80	36.7 Å²	36.7	37%	0.374	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	109.7	167.7	-175.8	170	174.8	0	0	108.3	V44 D102 L103 K105	V44-E100 HydrophobicContact CG2-CB 4.34Å; V44-E100 HydrophobicContact CG2-CG 4.21Å; V44-E100 VanDerWaalsContact CG2-OE2 3.24Å; V44-E100 WeakPolarHBondContact CG2-OE2 3.26Å; E100-D102 VanDerWaalsContact C-N 3.3Å; E100-D102 PolarHBondContact O-N 3.16Å; E100-L103 PolarHBondContact N-O 3.08Å; E100-L103 WeakPolarHBondContact O-CB 3.5Å; E100-L103 PolarHBondContact O-N 3.45Å; E100-K105 HydrophobicContact CB-CB 3.92Å; E100-K105 IonicContact OE1-NZ 2.71Å; E100-K105 WeakPolarHBondContact OE2-CD 3.46Å; E100-K105 WeakPolarHBondContact OE2-CE 3.37Å; E100-K105 WeakPolarHBondContact OE2-CG 3.46Å; E100-K105 IonicContact OE2-NZ 2.84Å; E100-K105 PolarHBondContact OE2-NZ 3.49Å
101	A	91.9	Very high	88.1	Confident	90 Å²	90	33.1 Å²	33.1	74%	0.744	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.8	46.6	-177.4	0	0	0	0	0	113.7	L103	A101-L103 PolarHBondContact O-N 3.11Å; A101-L103 VanDerWaalsContact O-N 3.12Å
102	D	92.4	Very high	88.2	Confident	122 Å²	122	30.4 Å²	30.4	65%	0.652	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	5.8	-178	-59.3	-42.5	0	0	0	115.5	P49 F50 N99 E100	P49-D102 WeakPolarHBondContact CA-O 3.25Å; F50-D102 PolarHBondContact N-O 2.87Å; N99-D102 PolarHBondContact ND2-OD1 3.18Å; N99-D102 WeakPolarHBondContact OD1-CA 3.42Å; N99-D102 PolarHBondContact OD1-N 2.93Å; E100-D102 VanDerWaalsContact C-N 3.3Å; E100-D102 PolarHBondContact O-N 3.16Å
103	L	91.2	Very high	88.2	Confident	49 Å²	49	32.3 Å²	32.3	26%	0.257	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	157.6	174.3	-62.8	169.9	0	0	0	111.3	V44 E100 A101 K105	V44-L103 HydrophobicContact CG1-CB 3.7Å; V44-L103 HydrophobicContact CG1-CD1 4.01Å; E100-L103 PolarHBondContact N-O 3.08Å; E100-L103 WeakPolarHBondContact O-CB 3.5Å; E100-L103 PolarHBondContact O-N 3.45Å; A101-L103 PolarHBondContact O-N 3.11Å; A101-L103 VanDerWaalsContact O-N 3.12Å; L103-K105 PolarHBondContact O-N 2.81Å
104	T	90.9	Very high	88	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	107.7	178.9	-55.2	0	0	0	0	110.4	L45 V48 P49 F50 M55 F68 F97	L45-T104 WeakPolarHBondContact CB-O 3.2Å; L45-T104 HydrophobicContact CD1-CG2 4.24Å; L45-T104 PolarHBondContact N-O 3.1Å; V48-T104 WeakPolarHBondContact O-CB 3.17Å; V48-T104 PolarHBondContact O-N 3.44Å; V48-T104 PolarHBondContact O-OG1 2.99Å; P49-T104 PolarHBondContact O-OG1 2.61Å; F50-T104 WeakPolarHBondContact CA-OG1 3.29Å; F50-T104 HydrophobicContact CD2-CG2 4.44Å; M55-T104 HydrophobicContact CE-CG2 4.14Å; M55-T104 VanDerWaalsContact CE-OG1 3.27Å; M55-T104 WeakPolarHBondContact CE-OG1 3.44Å; M55-T104 HydrophobicContact SD-CG2 3.68Å; M55-T104 PolarHBondContact SD-OG1 2.79Å; F68-T104 HydrophobicContact CE1-CG2 4.27Å; F97-T104 HydrophobicContact CB-CG2 4.28Å; F97-T104 HydrophobicContact CD1-CG2 3.81Å; F97-T104 HydrophobicContact CG-CG2 4.36Å
105	K	92.2	Very high	87.7	Confident	35 Å²	35	31.5 Å²	31.5	15%	0.152	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	121.8	163.4	-168.9	-168.4	-160.2	132.2	0	109.4	S42 A43 V44 F97 R98 E100 L103 W107	S42-K105 WeakPolarHBondContact OG-CE 3.49Å; A43-K105 CarbonylContact O-C 3.57Å; A43-K105 WeakPolarHBondContact O-CA 3.21Å; V44-K105 HydrophobicContact CG2-CB 4.35Å; V44-K105 HydrophobicContact CG2-CG 4.21Å; F97-K105 CarbonylContact C-O 3.48Å; F97-K105 WeakPolarHBondContact CA-O 3.48Å; R98-K105 HydrophobicContact CB-CB 4.34Å; R98-K105 PolarHBondContact N-O 2.87Å; R98-K105 PolarHBondContact O-N 3.42Å; E100-K105 HydrophobicContact CB-CB 3.92Å; E100-K105 IonicContact OE1-NZ 2.71Å; E100-K105 WeakPolarHBondContact OE2-CD 3.46Å; E100-K105 WeakPolarHBondContact OE2-CE 3.37Å; E100-K105 WeakPolarHBondContact OE2-CG 3.46Å; E100-K105 IonicContact OE2-NZ 2.84Å; E100-K105 PolarHBondContact OE2-NZ 3.49Å; L103-K105 PolarHBondContact O-N 2.81Å; K105-W107 HydrophobicContact CD-CZ2 4.07Å
106	V	90.3	Very high	87.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.5	174.1	67.5	0	0	0	0	110.8	S42 A43 L45 V72 V94 F97 L108	S42-V106 WeakPolarHBondContact CA-O 3.34Å; A43-V106 HydrophobicContact CB-CG1 4.08Å; A43-V106 PolarHBondContact N-O 3.41Å; A43-V106 WeakPolarHBondContact O-CG1 3.48Å; A43-V106 PolarHBondContact O-N 3.35Å; L45-V106 HydrophobicContact CD2-CG1 4.04Å; L45-V106 HydrophobicContact CG-CG1 4.26Å; V72-V106 HydrophobicContact CG1-CG1 4.39Å; V72-V106 HydrophobicContact CG1-CG2 4.16Å; V94-V106 HydrophobicContact CB-CG2 4.44Å; V94-V106 HydrophobicContact CG1-CG2 3.59Å; V94-V106 HydrophobicContact CG2-CG2 4.06Å; F97-V106 HydrophobicContact CD1-CB 4.03Å; F97-V106 HydrophobicContact CD1-CG2 3.8Å; F97-V106 HydrophobicContact CE1-CB 4.14Å; F97-V106 HydrophobicContact CE1-CG2 3.58Å; V106-L108 HydrophobicContact CG1-CD1 3.98Å; V106-L108 HydrophobicContact CG1-CG 4.25Å; V106-L108 HydrophobicContact CG2-CD2 4.12Å; V106-L108 HydrophobicContact CG2-CG 4.09Å
107	W	90	Very high	87.1	Confident	6 Å²	6	38.6 Å²	38.6	2%	0.023	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.1	174.5	-69.5	90.6	0	0	0	109.8	R95 C96 K105 I223 F228 E231 C232	R95-W107 HydrophobicContact CB-CB 4.42Å; R95-W107 PolarHBondContact N-O 3.41Å; C96-W107 PolarHBondContact O-N 2.96Å; K105-W107 HydrophobicContact CD-CZ2 4.07Å; W107-I223 HydrophobicContact CH2-CD1 4.16Å; W107-I223 HydrophobicContact CH2-CG2 3.75Å; W107-I223 HydrophobicContact CZ3-CD1 4.13Å; W107-I223 HydrophobicContact CZ3-CG2 3.68Å; W107-F228 HydrophobicContact CB-CE2 4.33Å; W107-F228 HydrophobicContact CD2-CD2 4.43Å; W107-F228 HydrophobicContact CE3-CB 4.36Å; W107-F228 AromaticContact CE3-CD2 3.2Å; W107-F228 HydrophobicContact CE3-CD2 3.2Å; W107-F228 AromaticContact CE3-CE2 3.59Å; W107-F228 HydrophobicContact CE3-CE2 3.59Å; W107-F228 AromaticContact CE3-CG 3.94Å; W107-F228 HydrophobicContact CE3-CG 3.94Å; W107-F228 HydrophobicContact CZ3-CB 3.88Å; W107-F228 AromaticContact CZ3-CD2 3.45Å; W107-F228 HydrophobicContact CZ3-CD2 3.45Å; W107-F228 VanDerWaalsContact CZ3-CD2 3.45Å; W107-F228 HydrophobicContact CZ3-CE2 4.29Å; W107-F228 AromaticContact CZ3-CG 3.97Å; W107-F228 HydrophobicContact CZ3-CG 3.97Å; W107-E231 HydrophobicContact CD2-CB 4.33Å; W107-E231 HydrophobicContact CH2-CB 3.91Å; W107-E231 HydrophobicContact CH2-CG 3.79Å; W107-E231 HydrophobicContact CZ2-CB 3.5Å; W107-E231 HydrophobicContact CZ2-CG 3.4Å; W107-E231 VanDerWaalsContact CZ2-CG 3.4Å; W107-E231 HydrophobicContact CZ3-CB 4.5Å; W107-C232 WeakPolarHBondContact CB-SG 3.2Å; W107-C232 VanDerWaalsContact CG-SG 3.58Å
108	L	85.6	Confident	86.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.5	-166.8	-68.7	162.1	0	0	0	111.1	M41 V72 V76 K93 V94 V106 L126 F228	M41-L108 HydrophobicContact CB-CB 4.42Å; M41-L108 HydrophobicContact CE-CB 4.33Å; M41-L108 HydrophobicContact CE-CD1 4.08Å; M41-L108 PolarHBondContact N-O 3.09Å; M41-L108 PolarHBondContact O-N 2.87Å; V72-L108 HydrophobicContact CG1-CD1 4.49Å; V72-L108 HydrophobicContact CG1-CD2 3.86Å; V76-L108 HydrophobicContact CG2-CD1 4.19Å; V76-L108 HydrophobicContact CG2-CD2 4.37Å; K93-L108 WeakPolarHBondContact O-CA 3.16Å; V94-L108 HydrophobicContact CB-CD2 4.41Å; V94-L108 HydrophobicContact CG2-CD2 3.61Å; V106-L108 HydrophobicContact CG1-CD1 3.98Å; V106-L108 HydrophobicContact CG1-CG 4.25Å; V106-L108 HydrophobicContact CG2-CD2 4.12Å; V106-L108 HydrophobicContact CG2-CG 4.09Å; L108-L126 HydrophobicContact CD1-CD1 4.21Å; L108-F228 WeakPolarHBondContact O-CE2 3.43Å; L108-F228 WeakPolarHBondContact O-CZ 3.41Å
109	E	83.7	Confident	86.5	Confident	9 Å²	9	38 Å²	38	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.9	164.9	-177.5	-171	150.8	0	0	107.7	Y39 Y91 S92 K93 R95	Y39-E109 CarbonylContact O-C 3.46Å; Y39-E109 WeakPolarHBondContact O-CA 3.32Å; Y91-E109 HydrophobicContact CE2-CG 3.98Å; Y91-E109 WeakPolarHBondContact CE2-OE1 3.32Å; Y91-E109 PolarHBondContact OH-OE1 2.98Å; S92-E109 CarbonylContact C-O 3.57Å; S92-E109 WeakPolarHBondContact CA-O 3.27Å; K93-E109 HydrophobicContact CB-CB 4.3Å; K93-E109 PolarHBondContact N-O 3.1Å; K93-E109 PolarHBondContact O-N 3.44Å; R95-E109 HydrophobicContact CG-CB 4.19Å; R95-E109 IonicContact CZ-OE2 3.66Å; R95-E109 IonicContact NE-OE2 3.62Å; R95-E109 IonicContact NH1-OE2 3.66Å; R95-E109 PolarHBondContact NH1-OE2 3.49Å
110	V	83	Confident	86.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.3	179.3	-174.8	0	0	0	0	109.3	R38 Y39 M41 V76 M80 Y89 Y91 A112 M119	R38-V110 CarbonylContact C-O 3.57Å; R38-V110 WeakPolarHBondContact CA-O 3.25Å; Y39-V110 WeakPolarHBondContact CD2-O 3.37Å; Y39-V110 PolarHBondContact N-O 3.5Å; Y39-V110 PolarHBondContact O-N 3.01Å; M41-V110 HydrophobicContact CE-CG2 3.75Å; M41-V110 HydrophobicContact SD-CB 4.46Å; M41-V110 HydrophobicContact SD-CG2 4.01Å; V76-V110 HydrophobicContact CG1-CG1 4.31Å; V76-V110 HydrophobicContact CG1-CG2 4.01Å; M80-V110 HydrophobicContact SD-CG1 4.16Å; Y89-V110 HydrophobicContact CD2-CG1 4.48Å; Y89-V110 HydrophobicContact CE2-CG1 4.46Å; Y91-V110 CarbonylContact O-C 3.53Å; Y91-V110 WeakPolarHBondContact O-CA 3.21Å; V110-A112 HydrophobicContact CG1-CB 4.45Å; V110-M119 HydrophobicContact CB-CE 3.93Å; V110-M119 HydrophobicContact CG1-CE 3.73Å; V110-M119 HydrophobicContact CG2-CE 4.3Å
111	G	81.5	Confident	85.9	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	118.6	169.4	0	0	0	0	0	110	K37 Q90 Y91	K37-G111 CarbonylContact O-C 3.57Å; K37-G111 WeakPolarHBondContact O-CA 3.01Å; Q90-G111 WeakPolarHBondContact CA-O 3.47Å; Q90-G111 WeakPolarHBondContact CB-O 3.4Å; Q90-G111 PolarHBondContact N-O 3.11Å; Y91-G111 PolarHBondContact N-O 2.86Å; Y91-G111 PolarHBondContact O-N 2.9Å
112	A	82.3	Confident	85.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	156.8	179	0	0	0	0	0	113.4	K37 Y39 M80 R88 V110 A114 M119	K37-A112 PolarHBondContact N-O 3.25Å; K37-A112 PolarHBondContact O-N 2.72Å; Y39-A112 HydrophobicContact CE2-CB 4.32Å; M80-A112 HydrophobicContact CE-CB 3.56Å; R88-A112 CarbonylContact O-C 3.6Å; R88-A112 WeakPolarHBondContact O-CA 3.27Å; R88-A112 WeakPolarHBondContact O-CB 3.31Å; V110-A112 HydrophobicContact CG1-CB 4.45Å; A112-A114 HydrophobicContact CB-CB 4.3Å; A112-A114 PolarHBondContact O-N 3.45Å; A112-M119 HydrophobicContact CB-SD 4.36Å
113	I	83.2	Confident	85.1	Confident	48 Å²	48	29.5 Å²	29.5	25%	0.246	15%	0.146	C	C	.	.	S	Bend	trans	-89.3	83.6	167.1	-54.8	170.6	0	0	0	108.2	A33 S34 P36 R88	A33-I113 WeakPolarHBondContact O-CG2 3.48Å; S34-I113 WeakPolarHBondContact O-CD1 3.35Å; P36-I113 HydrophobicContact CB-CG1 3.91Å; R88-I113 HydrophobicContact CB-CB 4.13Å; R88-I113 VanDerWaalsContact CB-O 3.26Å; R88-I113 WeakPolarHBondContact CB-O 3.2Å; R88-I113 WeakPolarHBondContact CD-O 3.45Å; R88-I113 HydrophobicContact CG-CB 4.23Å; R88-I113 VanDerWaalsContact CG-O 3.27Å; R88-I113 WeakPolarHBondContact CG-O 3.3Å; R88-I113 PolarHBondContact O-N 2.91Å
114	A	80.9	Confident	84.7	Confident	11 Å²	11	29.3 Å²	29.3	9%	0.091	15%	0.149	C	C	.	.			trans	-137.4	171.2	-173.7	0	0	0	0	0	112.8	Y39 M85 A112 Q118 M119	Y39-A114 HydrophobicContact CE2-CB 4.26Å; Y39-A114 PolarHBondContact OH-O 3.38Å; M85-A114 HydrophobicContact CE-CB 3.66Å; A112-A114 HydrophobicContact CB-CB 4.3Å; A112-A114 PolarHBondContact O-N 3.45Å; A114-Q118 HydrophobicContact CB-CB 4.26Å; A114-M119 HydrophobicContact CB-CG 3.9Å; A114-M119 HydrophobicContact CB-SD 3.86Å
115	T	81.4	Confident	84.1	Confident	72 Å²	72	30.5 Å²	30.5	44%	0.442	16%	0.159	S	C	.	.			trans	-90.6	163.6	161.7	70.5	0	0	0	0	110.3	E117 Q118 M119	T115-E117 VanDerWaalsContact C-N 3.3Å; T115-E117 PolarHBondContact O-N 2.75Å; T115-Q118 WeakPolarHBondContact O-CB 3.31Å; T115-Q118 PolarHBondContact O-N 3.25Å; T115-Q118 WeakPolarHBondContact OG1-CB 3.27Å; T115-Q118 WeakPolarHBondContact OG1-CG 3.05Å; T115-Q118 PolarHBondContact OG1-N 2.94Å; T115-M119 PolarHBondContact O-N 3.03Å; T115-M119 VanDerWaalsContact O-N 3.16Å
116	L	80.2	Confident	83.4	Confident	51 Å²	51	28.8 Å²	28.8	27%	0.267	15%	0.151	S	C	.	.	H	α-helix	trans	-62.1	-40.4	175	-176.5	60.2	0	0	0	111.7	Y39 Q118 M119 Q120 T218 V220	Y39-L116 HydrophobicContact CD1-CD1 4.47Å; L116-Q118 VanDerWaalsContact C-N 3.3Å; L116-Q118 PolarHBondContact O-N 3.29Å; L116-M119 PolarHBondContact O-N 3.16Å; L116-Q120 WeakPolarHBondContact O-CG 3.43Å; L116-Q120 PolarHBondContact O-N 3.38Å; L116-T218 VanDerWaalsContact CD1-O 3.27Å; L116-T218 WeakPolarHBondContact CD1-O 3.26Å; L116-T218 HydrophobicContact CD2-CG2 4.34Å; L116-V220 HydrophobicContact CD1-CG2 3.53Å
117	E	82.8	Confident	82.7	Confident	112 Å²	112	30 Å²	30	52%	0.523	16%	0.157	S	C	.	.	H	α-helix	trans	-60.7	-40.3	177.2	-167.8	-157.6	137.9	0	0	111.6	T115 Q120 K121	T115-E117 VanDerWaalsContact C-N 3.3Å; T115-E117 PolarHBondContact O-N 2.75Å; E117-Q120 WeakPolarHBondContact O-CB 3.47Å; E117-Q120 PolarHBondContact O-N 3.31Å; E117-K121 PolarHBondContact O-N 3.05Å; E117-K121 VanDerWaalsContact O-N 3.16Å; E117-K121 WeakPolarHBondContact OE1-CE 3.4Å; E117-K121 IonicContact OE1-NZ 3.24Å; E117-K121 PolarHBondContact OE1-NZ 3.4Å
118	Q	85.7	Confident	81.7	Confident	44 Å²	44	35.7 Å²	35.7	21%	0.206	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-43.8	174.3	-82.2	178.5	-35.2	0	0	112.1	M85 A114 T115 L116 Q120 K121 V122	M85-Q118 HydrophobicContact CE-CB 4.07Å; M85-Q118 HydrophobicContact SD-CB 3.55Å; M85-Q118 VanDerWaalsContact SD-CB 3.55Å; M85-Q118 HydrophobicContact SD-CG 3.72Å; A114-Q118 HydrophobicContact CB-CB 4.26Å; T115-Q118 WeakPolarHBondContact O-CB 3.31Å; T115-Q118 PolarHBondContact O-N 3.25Å; T115-Q118 WeakPolarHBondContact OG1-CB 3.27Å; T115-Q118 WeakPolarHBondContact OG1-CG 3.05Å; T115-Q118 PolarHBondContact OG1-N 2.94Å; L116-Q118 VanDerWaalsContact C-N 3.3Å; L116-Q118 PolarHBondContact O-N 3.29Å; Q118-Q120 VanDerWaalsContact C-N 3.33Å; Q118-Q120 PolarHBondContact O-N 2.89Å; Q118-K121 WeakPolarHBondContact O-CB 3.42Å; Q118-K121 PolarHBondContact O-N 3.21Å; Q118-V122 PolarHBondContact O-N 3.24Å
119	M	85.4	Confident	80.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-71.8	-26.5	177.1	-65.2	-52.7	-53.6	0	0	113.4	Y39 M41 M80 M85 V110 A112 A114 T115 L116 K121 V122 T123 V220	Y39-M119 HydrophobicContact CD1-CB 4.09Å; Y39-M119 HydrophobicContact CD1-CG 3.71Å; Y39-M119 HydrophobicContact CD2-CE 4.41Å; Y39-M119 HydrophobicContact CD2-CG 3.71Å; Y39-M119 HydrophobicContact CD2-SD 4.21Å; Y39-M119 HydrophobicContact CE1-CB 4.38Å; Y39-M119 HydrophobicContact CE1-CG 3.76Å; Y39-M119 HydrophobicContact CE2-CG 3.78Å; Y39-M119 HydrophobicContact CE2-SD 4.36Å; Y39-M119 HydrophobicContact CG-CB 4.27Å; Y39-M119 HydrophobicContact CG-CG 3.68Å; M41-M119 HydrophobicContact CE-CE 4.27Å; M41-M119 HydrophobicContact SD-CB 4.35Å; M41-M119 HydrophobicContact SD-CE 3.4Å; M41-M119 WeakPolarHBondContact SD-CE 3.43Å; M80-M119 HydrophobicContact CE-SD 4.49Å; M85-M119 HydrophobicContact CE-SD 3.98Å; V110-M119 HydrophobicContact CB-CE 3.93Å; V110-M119 HydrophobicContact CG1-CE 3.73Å; V110-M119 HydrophobicContact CG2-CE 4.3Å; A112-M119 HydrophobicContact CB-SD 4.36Å; A114-M119 HydrophobicContact CB-CG 3.9Å; A114-M119 HydrophobicContact CB-SD 3.86Å; T115-M119 PolarHBondContact O-N 3.03Å; T115-M119 VanDerWaalsContact O-N 3.16Å; L116-M119 PolarHBondContact O-N 3.16Å; M119-K121 VanDerWaalsContact C-N 3.32Å; M119-V122 HydrophobicContact CE-CB 4.26Å; M119-V122 HydrophobicContact CE-CG1 4.47Å; M119-V122 HydrophobicContact CE-CG2 4.06Å; M119-V122 PolarHBondContact O-N 3.4Å; M119-V122 HydrophobicContact SD-CG2 4.22Å; M119-T123 PolarHBondContact O-N 2.84Å; M119-T123 PolarHBondContact O-OG1 2.85Å; M119-V220 HydrophobicContact CB-CG2 3.94Å
120	Q	84.7	Confident	78.8	Confident	76 Å²	76	39.9 Å²	39.9	36%	0.355	22%	0.219	S	C	.	.	H	α-helix	trans	-61.6	-41	168.4	-77.4	170.4	-5.3	0	0	111.1	L116 E117 Q118 V122 T123 S124 V220	L116-Q120 WeakPolarHBondContact O-CG 3.43Å; L116-Q120 PolarHBondContact O-N 3.38Å; E117-Q120 WeakPolarHBondContact O-CB 3.47Å; E117-Q120 PolarHBondContact O-N 3.31Å; Q118-Q120 VanDerWaalsContact C-N 3.33Å; Q118-Q120 PolarHBondContact O-N 2.89Å; Q120-V122 PolarHBondContact O-N 3.17Å; Q120-T123 PolarHBondContact O-N 2.82Å; Q120-S124 WeakPolarHBondContact O-CB 3.31Å; Q120-S124 PolarHBondContact O-N 2.86Å; Q120-S124 PolarHBondContact O-OG 3.43Å; Q120-V220 HydrophobicContact CB-CG1 4.33Å; Q120-V220 HydrophobicContact CG-CB 4.31Å; Q120-V220 HydrophobicContact CG-CG1 3.73Å; Q120-V220 HydrophobicContact CG-CG2 4.15Å
121	K	84.3	Confident	77.5	Confident	106 Å²	106	39.9 Å²	39.9	46%	0.461	22%	0.219	S	C	.	.	H	α-helix	trans	-61	-42.7	175.5	-65.9	173	-173	169.6	0	111.8	E117 Q118 M119 T123 S124 A125	E117-K121 PolarHBondContact O-N 3.05Å; E117-K121 VanDerWaalsContact O-N 3.16Å; E117-K121 WeakPolarHBondContact OE1-CE 3.4Å; E117-K121 IonicContact OE1-NZ 3.24Å; E117-K121 PolarHBondContact OE1-NZ 3.4Å; Q118-K121 WeakPolarHBondContact O-CB 3.42Å; Q118-K121 PolarHBondContact O-N 3.21Å; M119-K121 VanDerWaalsContact C-N 3.32Å; K121-T123 PolarHBondContact O-N 3.24Å; K121-S124 PolarHBondContact O-N 2.81Å; K121-A125 WeakPolarHBondContact O-CB 3.08Å; K121-A125 PolarHBondContact O-N 2.98Å
122	V	83.1	Confident	76.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-49.6	173.5	179.9	0	0	0	0	110.9	M41 V76 M79 M80 I83 Q118 M119 Q120 A125 L126	M41-V122 HydrophobicContact CE-CG1 4.29Å; V76-V122 HydrophobicContact CG1-CG1 4.28Å; M79-V122 HydrophobicContact CB-CG1 4.38Å; M80-V122 HydrophobicContact CG-CG2 3.76Å; I83-V122 HydrophobicContact CD1-CG2 3.51Å; Q118-V122 PolarHBondContact O-N 3.24Å; M119-V122 HydrophobicContact CE-CB 4.26Å; M119-V122 HydrophobicContact CE-CG1 4.47Å; M119-V122 HydrophobicContact CE-CG2 4.06Å; M119-V122 PolarHBondContact O-N 3.4Å; M119-V122 HydrophobicContact SD-CG2 4.22Å; Q120-V122 PolarHBondContact O-N 3.17Å; V122-A125 PolarHBondContact O-N 2.91Å; V122-L126 HydrophobicContact CG1-CD1 4.39Å; V122-L126 PolarHBondContact O-N 3.4Å; V122-L126 VanDerWaalsContact O-N 3.15Å
123	T	83.9	Confident	75.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.2	-39.2	-176.1	-53.8	0	0	0	0	112.1	M41 S42 A43 M119 Q120 K121 L126 Q127 V220	M41-T123 WeakPolarHBondContact CE-OG1 3.39Å; M41-T123 PolarHBondContact SD-OG1 3.17Å; S42-T123 WeakPolarHBondContact O-CG2 2.96Å; A43-T123 HydrophobicContact CB-CG2 4.27Å; M119-T123 PolarHBondContact O-N 2.84Å; M119-T123 PolarHBondContact O-OG1 2.85Å; Q120-T123 PolarHBondContact O-N 2.82Å; K121-T123 PolarHBondContact O-N 3.24Å; T123-L126 WeakPolarHBondContact O-CB 3.4Å; T123-L126 PolarHBondContact O-N 3.3Å; T123-Q127 WeakPolarHBondContact O-CG 3.45Å; T123-Q127 PolarHBondContact O-N 3.22Å; T123-Q127 VanDerWaalsContact O-N 3.16Å; T123-V220 HydrophobicContact CG2-CG1 3.92Å; T123-V220 WeakPolarHBondContact OG1-CG1 3.4Å
124	S	82.9	Confident	75.1	Confident	44 Å²	44	50.4 Å²	50.4	31%	0.308	27%	0.268	S	S	.	.	H	α-helix	trans	-65.1	-38.9	174.9	-70.9	0	0	0	0	112.2	Q120 K121 L126 Q127 N128	Q120-S124 WeakPolarHBondContact O-CB 3.31Å; Q120-S124 PolarHBondContact O-N 2.86Å; Q120-S124 PolarHBondContact O-OG 3.43Å; K121-S124 PolarHBondContact O-N 2.81Å; S124-L126 VanDerWaalsContact C-N 3.32Å; S124-L126 PolarHBondContact O-N 2.94Å; S124-Q127 PolarHBondContact O-N 3.14Å; S124-N128 VanDerWaalsContact O-CB 3.27Å; S124-N128 WeakPolarHBondContact O-CB 3.37Å; S124-N128 VanDerWaalsContact O-CG 3.24Å; S124-N128 PolarHBondContact O-N 3.36Å; S124-N128 PolarHBondContact O-ND2 3.32Å
125	A	78.7	Confident	74.8	Confident	25 Å²	25	50.6 Å²	50.6	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-64.2	-37.4	176.1	0	0	0	0	0	112.1	M79 K121 V122	M79-A125 HydrophobicContact CE-CB 3.75Å; M79-A125 WeakPolarHBondContact CE-O 3.47Å; M79-A125 HydrophobicContact CG-CB 4.12Å; M79-A125 HydrophobicContact SD-CB 3.51Å; M79-A125 VanDerWaalsContact SD-CB 3.51Å; K121-A125 WeakPolarHBondContact O-CB 3.08Å; K121-A125 PolarHBondContact O-N 2.98Å; V122-A125 PolarHBondContact O-N 2.91Å
126	L	77.5	Confident	74.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.4	-38.8	172.8	-103.9	142.3	0	0	0	113.2	A43 L45 V72 V76 M79 L108 V122 T123 S124 Y136	A43-L126 HydrophobicContact CB-CB 4.05Å; L45-L126 HydrophobicContact CD2-CD2 3.86Å; V72-L126 HydrophobicContact CG1-CD2 4.4Å; V76-L126 HydrophobicContact CG2-CD1 3.72Å; M79-L126 HydrophobicContact CE-CB 4.47Å; M79-L126 HydrophobicContact CE-CG 4.14Å; M79-L126 HydrophobicContact SD-CB 4.19Å; M79-L126 HydrophobicContact SD-CD1 3.99Å; M79-L126 HydrophobicContact SD-CG 3.73Å; M79-L126 PolarHBondContact SD-N 2.89Å; L108-L126 HydrophobicContact CD1-CD1 4.21Å; V122-L126 HydrophobicContact CG1-CD1 4.39Å; V122-L126 PolarHBondContact O-N 3.4Å; V122-L126 VanDerWaalsContact O-N 3.15Å; T123-L126 WeakPolarHBondContact O-CB 3.4Å; T123-L126 PolarHBondContact O-N 3.3Å; S124-L126 VanDerWaalsContact C-N 3.32Å; S124-L126 PolarHBondContact O-N 2.94Å; L126-Y136 HydrophobicContact CD2-CD1 4.34Å; L126-Y136 HydrophobicContact CD2-CE1 3.96Å
127	Q	76.6	Confident	74.8	Confident	25 Å²	25	47.6 Å²	47.6	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-77.6	-40.7	179.5	-73.5	171.7	-13	0	0	112.9	A43 T46 T123 S124 G129	A43-Q127 HydrophobicContact CB-CG 3.86Å; T46-Q127 PolarHBondContact OG1-O 3Å; T123-Q127 WeakPolarHBondContact O-CG 3.45Å; T123-Q127 PolarHBondContact O-N 3.22Å; T123-Q127 VanDerWaalsContact O-N 3.16Å; S124-Q127 PolarHBondContact O-N 3.14Å; Q127-G129 PolarHBondContact O-N 2.91Å; Q127-G129 VanDerWaalsContact O-N 3.12Å
128	N	68.9	Low	74.6	Confident	125 Å²	125	44 Å²	44	67%	0.668	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	24.8	-168.1	-67	-18.3	0	0	0	113.9	S124 V130	S124-N128 VanDerWaalsContact O-CB 3.27Å; S124-N128 WeakPolarHBondContact O-CB 3.37Å; S124-N128 VanDerWaalsContact O-CG 3.24Å; S124-N128 PolarHBondContact O-N 3.36Å; S124-N128 PolarHBondContact O-ND2 3.32Å; N128-V130 VanDerWaalsContact C-N 3.28Å; N128-V130 PolarHBondContact O-N 3.27Å; N128-V130 VanDerWaalsContact O-N 3.14Å
129	G	53.5	Low	74.4	Confident	26 Å²	26	42.2 Å²	42.2	27%	0.268	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	8.9	165.1	0	0	0	0	0	116.8	Q127 A131 K132	Q127-G129 PolarHBondContact O-N 2.91Å; Q127-G129 VanDerWaalsContact O-N 3.12Å; G129-A131 PolarHBondContact O-N 3.11Å; G129-K132 PolarHBondContact O-N 3.01Å
130	V	54.7	Low	74.3	Confident	71 Å²	71	43.4 Å²	43.4	43%	0.43	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-51.8	-23.7	164.5	-170.3	0	0	0	0	110.1	M79 N128	M79-V130 HydrophobicContact CE-CB 4.47Å; N128-V130 VanDerWaalsContact C-N 3.28Å; N128-V130 PolarHBondContact O-N 3.27Å; N128-V130 VanDerWaalsContact O-N 3.14Å
131	A	54.4	Low	74.1	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.008	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-89.9	5.3	-174.5	0	0	0	0	0	117.5	M79 G129 M133 G134 Y136 Y137	M79-A131 HydrophobicContact CE-CB 4.41Å; G129-A131 PolarHBondContact O-N 3.11Å; A131-M133 PolarHBondContact O-N 3.43Å; A131-M133 VanDerWaalsContact O-N 3.16Å; A131-G134 VanDerWaalsContact C-N 3.31Å; A131-G134 WeakPolarHBondContact O-CA 3.17Å; A131-G134 PolarHBondContact O-N 3.15Å; A131-Y136 HydrophobicContact CB-CD1 4.03Å; A131-Y136 HydrophobicContact CB-CE1 3.11Å; A131-Y136 HydrophobicContact CB-CE2 4.42Å; A131-Y136 VanDerWaalsContact CB-OH 3.27Å; A131-Y136 WeakPolarHBondContact CB-OH 3.5Å; A131-Y137 WeakPolarHBondContact O-CB 3.32Å
132	K	60.8	Low	73.6	Confident	111 Å²	111	41.8 Å²	41.8	48%	0.483	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-60.6	-19.9	161.7	-77.6	-168.2	-177.4	178.8	0	112.6	D47 G129 Y137	D47-K132 HydrophobicContact CB-CG 4.27Å; D47-K132 WeakPolarHBondContact OD1-CE 3.44Å; D47-K132 IonicContact OD1-NZ 3.86Å; D47-K132 PolarHBondContact OD1-NZ 3.34Å; D47-K132 VanDerWaalsContact OD1-NZ 3.14Å; D47-K132 WeakPolarHBondContact OD2-CE 3.34Å; D47-K132 WeakPolarHBondContact OD2-CG 3.42Å; G129-K132 PolarHBondContact O-N 3.01Å; K132-Y137 HydrophobicContact CB-CD1 4.37Å; K132-Y137 HydrophobicContact CB-CE1 4.47Å; K132-Y137 HydrophobicContact CG-CD2 4.34Å; K132-Y137 HydrophobicContact CG-CE2 4.25Å; K132-Y137 WeakPolarHBondContact O-CD1 3.43Å
133	M	65.7	Low	73	Confident	158 Å²	158	45 Å²	45	78%	0.778	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-102.9	12.5	170	-57.1	-161.9	-64.7	0	0	112.3	R78 A131	R78-M133 PolarHBondContact NH1-O 3.05Å; A131-M133 PolarHBondContact O-N 3.43Å; A131-M133 VanDerWaalsContact O-N 3.16Å
134	G	71.1	Confident	72.2	Confident	1 Å²	1	47 Å²	47	1%	0.01	27%	0.266	C	S	.	.	S	Bend	trans	-88.3	149.1	-178.7	0	0	0	0	0	111.6	D75 A131 Y136 Y137 A138	D75-G134 VanDerWaalsContact OD1-CA 3.25Å; D75-G134 WeakPolarHBondContact OD1-CA 3.01Å; A131-G134 VanDerWaalsContact C-N 3.31Å; A131-G134 WeakPolarHBondContact O-CA 3.17Å; A131-G134 PolarHBondContact O-N 3.15Å; G134-Y136 PolarHBondContact O-N 3.17Å; G134-Y136 VanDerWaalsContact O-N 3.15Å; G134-Y137 PolarHBondContact O-N 3.38Å; G134-A138 PolarHBondContact O-N 2.95Å; G134-A138 VanDerWaalsContact O-N 3.09Å
135	P	75.3	Confident	71.1	Confident	14 Å²	14	54.8 Å²	54.8	9%	0.091	29%	0.294	C	S	.	.	H	α-helix	trans	-40.5	-42.9	167.9	-32.5	26.5	0	0	0	115.1	H74 D75 Y137 A138 F139	H74-P135 HydrophobicContact CB-CB 4.24Å; H74-P135 HydrophobicContact CB-CG 4.27Å; H74-P135 WeakPolarHBondContact ND1-CG 3.18Å; D75-P135 WeakPolarHBondContact OD1-CD 3.34Å; P135-Y137 VanDerWaalsContact C-N 3.35Å; P135-Y137 PolarHBondContact O-N 3.03Å; P135-A138 PolarHBondContact O-N 3.33Å; P135-F139 VanDerWaalsContact O-CB 3.28Å; P135-F139 WeakPolarHBondContact O-CB 3.27Å; P135-F139 PolarHBondContact O-N 2.79Å
136	Y	81.4	Confident	70.5	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.4	-38.2	-178.2	83.9	-115.8	0	0	0	112.6	L45 V48 F68 S71 V72 D75 L126 A131 G134 F139 S140	L45-Y136 HydrophobicContact CB-CE2 4.36Å; L45-Y136 HydrophobicContact CD1-CD2 4.15Å; L45-Y136 HydrophobicContact CD1-CE2 4.17Å; L45-Y136 HydrophobicContact CD2-CE1 3.94Å; L45-Y136 HydrophobicContact CD2-CE2 4.33Å; V48-Y136 HydrophobicContact CG2-CD2 3.89Å; V48-Y136 HydrophobicContact CG2-CE2 3.64Å; F68-Y136 HydrophobicContact CE2-CD2 4.21Å; F68-Y136 WeakPolarHBondContact CE2-O 3.47Å; F68-Y136 HydrophobicContact CZ-CD2 4.49Å; S71-Y136 WeakPolarHBondContact OG-CA 3.42Å; V72-Y136 HydrophobicContact CG2-CD1 4.49Å; V72-Y136 HydrophobicContact CG2-CG 4.24Å; D75-Y136 HydrophobicContact CB-CD1 4.08Å; D75-Y136 WeakPolarHBondContact OD2-CD1 2.75Å; D75-Y136 PolarHBondContact OD2-N 3.4Å; L126-Y136 HydrophobicContact CD2-CD1 4.34Å; L126-Y136 HydrophobicContact CD2-CE1 3.96Å; A131-Y136 HydrophobicContact CB-CD1 4.03Å; A131-Y136 HydrophobicContact CB-CE1 3.11Å; A131-Y136 HydrophobicContact CB-CE2 4.42Å; A131-Y136 VanDerWaalsContact CB-OH 3.27Å; A131-Y136 WeakPolarHBondContact CB-OH 3.5Å; G134-Y136 PolarHBondContact O-N 3.17Å; G134-Y136 VanDerWaalsContact O-N 3.15Å; Y136-F139 PolarHBondContact O-N 2.97Å; Y136-S140 WeakPolarHBondContact O-CB 3.44Å; Y136-S140 PolarHBondContact O-N 3.27Å
137	Y	80.4	Confident	69.7	Low	61 Å²	61	63 Å²	63	24%	0.239	32%	0.321	C	S	.	.	H	α-helix	trans	-72.1	-43.8	-179.6	-176.2	-95.8	0	0	0	110.1	D47 V48 A131 K132 G134 P135 F139 S140 Q141	D47-Y137 HydrophobicContact CB-CD2 3.91Å; D47-Y137 HydrophobicContact CB-CE2 3.76Å; V48-Y137 HydrophobicContact CG2-CD2 4.49Å; A131-Y137 WeakPolarHBondContact O-CB 3.32Å; K132-Y137 HydrophobicContact CB-CD1 4.37Å; K132-Y137 HydrophobicContact CB-CE1 4.47Å; K132-Y137 HydrophobicContact CG-CD2 4.34Å; K132-Y137 HydrophobicContact CG-CE2 4.25Å; K132-Y137 WeakPolarHBondContact O-CD1 3.43Å; G134-Y137 PolarHBondContact O-N 3.38Å; P135-Y137 VanDerWaalsContact C-N 3.35Å; P135-Y137 PolarHBondContact O-N 3.03Å; Y137-F139 VanDerWaalsContact C-N 3.26Å; Y137-F139 PolarHBondContact O-N 3.11Å; Y137-S140 PolarHBondContact O-N 3.42Å; Y137-S140 VanDerWaalsContact O-N 3.15Å; Y137-S140 PolarHBondContact O-OG 3.28Å; Y137-Q141 HydrophobicContact CD1-CG 4.44Å; Y137-Q141 HydrophobicContact CE1-CG 4.19Å; Y137-Q141 WeakPolarHBondContact O-CG 3.42Å; Y137-Q141 PolarHBondContact O-N 2.69Å
138	A	78.1	Confident	69	Low	36 Å²	36	65 Å²	65	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-57.3	-42.1	173.5	0	0	0	0	0	111.7	G134 P135 Q141 F184	G134-A138 PolarHBondContact O-N 2.95Å; G134-A138 VanDerWaalsContact O-N 3.09Å; P135-A138 PolarHBondContact O-N 3.33Å; A138-Q141 PolarHBondContact O-N 3.26Å; A138-F184 HydrophobicContact CB-CE2 4.4Å; A138-F184 HydrophobicContact CB-CZ 4.02Å
139	F	82	Confident	68.5	Low	7 Å²	7	66.9 Å²	66.9	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-66.9	-40.3	176.1	-168	-81.6	0	0	0	112.3	W64 G67 F68 P135 Y136 Y137 Q141 S142 V147 H155	W64-F139 AromaticContact CD1-CE1 3.82Å; W64-F139 HydrophobicContact CD2-CE1 4.22Å; W64-F139 HydrophobicContact CG-CE1 4.12Å; W64-F139 AromaticContact NE1-CE1 3.82Å; W64-F139 WeakPolarHBondContact O-CE1 3.41Å; G67-F139 VanDerWaalsContact CA-CZ 3.46Å; F68-F139 HydrophobicContact CB-CD1 3.86Å; F68-F139 HydrophobicContact CB-CE1 3.85Å; F68-F139 AromaticContact CD2-CD1 3.95Å; F68-F139 HydrophobicContact CD2-CD1 3.95Å; F68-F139 HydrophobicContact CG-CD1 4.39Å; F68-F139 VanDerWaalsContact N-CE1 3.3Å; P135-F139 VanDerWaalsContact O-CB 3.28Å; P135-F139 WeakPolarHBondContact O-CB 3.27Å; P135-F139 PolarHBondContact O-N 2.79Å; Y136-F139 PolarHBondContact O-N 2.97Å; Y137-F139 VanDerWaalsContact C-N 3.26Å; Y137-F139 PolarHBondContact O-N 3.11Å; F139-Q141 PolarHBondContact O-N 2.75Å; F139-S142 WeakPolarHBondContact O-CB 3.43Å; F139-S142 PolarHBondContact O-N 3.32Å; F139-V147 HydrophobicContact CE1-CG2 4.31Å; F139-V147 HydrophobicContact CE2-CG1 4.22Å; F139-V147 HydrophobicContact CE2-CG2 4.37Å; F139-V147 HydrophobicContact CZ-CB 4.47Å; F139-V147 HydrophobicContact CZ-CG1 3.8Å; F139-V147 HydrophobicContact CZ-CG2 3.79Å; F139-H155 AromaticContact CD2-CE1 3.99Å
140	S	82	Confident	68.6	Low	24 Å²	24	67.4 Å²	67.4	17%	0.168	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-24.7	-179.4	73.6	0	0	0	0	113.1	Y136 Y137 S142	Y136-S140 WeakPolarHBondContact O-CB 3.44Å; Y136-S140 PolarHBondContact O-N 3.27Å; Y137-S140 PolarHBondContact O-N 3.42Å; Y137-S140 VanDerWaalsContact O-N 3.15Å; Y137-S140 PolarHBondContact O-OG 3.28Å; S140-S142 PolarHBondContact O-N 2.91Å
141	Q	81.7	Confident	68.8	Low	114 Å²	114	67.7 Å²	67.7	53%	0.533	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.1	171.5	-56.8	-43.5	-60.8	0	0	113.2	Y137 A138 F139	Y137-Q141 HydrophobicContact CD1-CG 4.44Å; Y137-Q141 HydrophobicContact CE1-CG 4.19Å; Y137-Q141 WeakPolarHBondContact O-CG 3.42Å; Y137-Q141 PolarHBondContact O-N 2.69Å; A138-Q141 PolarHBondContact O-N 3.26Å; F139-Q141 PolarHBondContact O-N 2.75Å
142	S	73.1	Confident	69	Low	35 Å²	35	68.1 Å²	68.1	25%	0.245	34%	0.335	C	S	.	.	S	Bend	trans	-80	127.4	-177.8	-61.2	0	0	0	0	111	W64 F139 S140	W64-S142 PolarHBondContact NE1-O 3.05Å; F139-S142 WeakPolarHBondContact O-CB 3.43Å; F139-S142 PolarHBondContact O-N 3.32Å; S140-S142 PolarHBondContact O-N 2.91Å
143	P	69.2	Low	68.9	Low	66 Å²	66	66.5 Å²	66.5	43%	0.429	33%	0.329	S	S	.	.			trans	-60.3	131.6	-178.5	-22.3	32.3	0	0	0	111.5	K145 R146 V147	P143-K145 PolarHBondContact O-N 2.81Å; P143-K145 VanDerWaalsContact O-N 3.09Å; P143-R146 HydrophobicContact CB-CB 4.37Å; P143-R146 HydrophobicContact CB-CG 4.31Å; P143-R146 PolarHBondContact O-N 2.76Å; P143-V147 PolarHBondContact O-N 2.84Å
144	P	67.4	Low	68.6	Low	44 Å²	44	60.7 Å²	60.7	29%	0.286	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-32.7	-177	-28.8	35.2	0	0	0	115.5	F54 W64 R146	F54-P144 HydrophobicContact CD1-CB 3.8Å; F54-P144 HydrophobicContact CD1-CG 4.35Å; F54-P144 HydrophobicContact CD2-CB 4Å; F54-P144 HydrophobicContact CD2-CG 3.62Å; F54-P144 HydrophobicContact CE1-CB 3.4Å; F54-P144 VanDerWaalsContact CE1-CB 3.4Å; F54-P144 HydrophobicContact CE1-CG 4.08Å; F54-P144 HydrophobicContact CE2-CB 3.67Å; F54-P144 HydrophobicContact CE2-CG 3.34Å; F54-P144 HydrophobicContact CG-CB 4.09Å; F54-P144 HydrophobicContact CG-CG 4.15Å; F54-P144 HydrophobicContact CZ-CB 3.34Å; F54-P144 HydrophobicContact CZ-CG 3.59Å; W64-P144 HydrophobicContact CB-CB 4.3Å; W64-P144 VanDerWaalsContact CD1-CA 3.44Å; W64-P144 HydrophobicContact CG-CB 3.99Å; W64-P144 HydrophobicContact CG-CG 4.23Å; P144-R146 VanDerWaalsContact C-N 3.26Å; P144-R146 PolarHBondContact O-N 2.95Å
145	K	61.6	Low	68	Low	206 Å²	206	61.8 Å²	61.8	90%	0.896	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.7	177.4	-65.9	-175.4	179	-179.9	0	114.2	P143	P143-K145 PolarHBondContact O-N 2.81Å; P143-K145 VanDerWaalsContact O-N 3.09Å
146	R	65	Low	67	Low	191 Å²	191	62.9 Å²	62.9	72%	0.721	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-14.5	-178.8	-71.3	-168.1	-172.9	-176.2	2.9	113.9	P143 P144 T148	P143-R146 HydrophobicContact CB-CB 4.37Å; P143-R146 HydrophobicContact CB-CG 4.31Å; P143-R146 PolarHBondContact O-N 2.76Å; P144-R146 VanDerWaalsContact C-N 3.26Å; P144-R146 PolarHBondContact O-N 2.95Å; R146-T148 PolarHBondContact O-N 2.71Å; R146-T148 VanDerWaalsContact O-N 3.17Å
147	V	60.7	Low	65.8	Low	6 Å²	6	64.8 Å²	64.8	4%	0.036	32%	0.324	C	S	.	.			trans	-60.3	123.4	-180	173	0	0	0	0	109.3	M63 W64 F139 P143 E151 V152	M63-V147 HydrophobicContact CB-CG1 4.33Å; M63-V147 WeakPolarHBondContact CE-O 3.33Å; W64-V147 HydrophobicContact CG-CG2 4.43Å; F139-V147 HydrophobicContact CE1-CG2 4.31Å; F139-V147 HydrophobicContact CE2-CG1 4.22Å; F139-V147 HydrophobicContact CE2-CG2 4.37Å; F139-V147 HydrophobicContact CZ-CB 4.47Å; F139-V147 HydrophobicContact CZ-CG1 3.8Å; F139-V147 HydrophobicContact CZ-CG2 3.79Å; P143-V147 PolarHBondContact O-N 2.84Å; V147-E151 VanDerWaalsContact CA-OE2 3.27Å; V147-E151 WeakPolarHBondContact CA-OE2 3.46Å; V147-V152 HydrophobicContact CG1-CG2 3.72Å
148	T	62.8	Low	64.8	Low	69 Å²	69	64.6 Å²	64.6	42%	0.423	33%	0.327	S	S	.	.			trans	-102.1	160.7	176.9	62.2	0	0	0	0	111.1	R146 A150 E151 V152	R146-T148 PolarHBondContact O-N 2.71Å; R146-T148 VanDerWaalsContact O-N 3.17Å; T148-A150 PolarHBondContact O-N 2.05Å; T148-E151 PolarHBondContact N-OE2 3.37Å; T148-E151 PolarHBondContact O-N 3.37Å; T148-E151 VanDerWaalsContact O-N 3.16Å; T148-E151 PolarHBondContact OG1-N 2.81Å; T148-E151 PolarHBondContact OG1-OE2 3.12Å; T148-V152 PolarHBondContact O-N 3.45Å
149	Y	57.2	Low	63.9	Low	163 Å²	163	63.3 Å²	63.3	64%	0.639	32%	0.315	S	S	*	.	H	α-helix	trans	-57	-35.7	174	-163.8	-93.1	0	0	0	111.8	M63 E151 V152 Q153	M63-Y149 HydrophobicContact SD-CD2 4.49Å; Y149-E151 PolarHBondContact O-N 2.93Å; Y149-V152 PolarHBondContact O-N 2.8Å; Y149-Q153 HydrophobicContact CD1-CB 4.44Å; Y149-Q153 VanDerWaalsContact CD1-OE1 3.31Å; Y149-Q153 HydrophobicContact CE1-CB 4.49Å; Y149-Q153 VanDerWaalsContact O-CB 3.25Å; Y149-Q153 WeakPolarHBondContact O-CB 3.43Å; Y149-Q153 PolarHBondContact O-N 3.19Å
150	A	56.4	Low	62.6	Low	37 Å²	37	65 Å²	65	31%	0.306	32%	0.324	S	S	.	.	H	α-helix	trans	-59.5	-42.8	176.7	0	0	0	0	0	112.8	T148 Q153 T154	T148-A150 PolarHBondContact O-N 2.05Å; A150-Q153 PolarHBondContact O-N 3Å; A150-T154 WeakPolarHBondContact O-CB 3.5Å; A150-T154 PolarHBondContact O-N 3.03Å; A150-T154 PolarHBondContact O-OG1 3Å
151	E	58.9	Low	61.3	Low	78 Å²	78	66.9 Å²	66.9	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-66.8	-39.6	178	-73.4	168.2	139.3	0	0	112.2	V147 T148 Y149 T154 H155	V147-E151 VanDerWaalsContact CA-OE2 3.27Å; V147-E151 WeakPolarHBondContact CA-OE2 3.46Å; T148-E151 PolarHBondContact N-OE2 3.37Å; T148-E151 PolarHBondContact O-N 3.37Å; T148-E151 VanDerWaalsContact O-N 3.16Å; T148-E151 PolarHBondContact OG1-N 2.81Å; T148-E151 PolarHBondContact OG1-OE2 3.12Å; Y149-E151 PolarHBondContact O-N 2.93Å; E151-T154 PolarHBondContact O-N 2.84Å; E151-H155 PolarHBondContact O-N 3.12Å; E151-H155 PolarHBondContact O-ND1 2.91Å
152	V	57.5	Low	60	Low	10 Å²	10	62.1 Å²	62.1	6%	0.061	31%	0.31	C	S	.	.	H	α-helix	trans	-65.7	-42.2	175.4	178.4	0	0	0	0	111.1	M63 I66 V147 T148 Y149 T154 H155 S156	M63-V152 HydrophobicContact CB-CG2 4.46Å; M63-V152 WeakPolarHBondContact O-CG2 3.46Å; I66-V152 HydrophobicContact CB-CG1 4.32Å; I66-V152 HydrophobicContact CG2-CG1 3.61Å; V147-V152 HydrophobicContact CG1-CG2 3.72Å; T148-V152 PolarHBondContact O-N 3.45Å; Y149-V152 PolarHBondContact O-N 2.8Å; V152-T154 VanDerWaalsContact C-N 3.34Å; V152-H155 PolarHBondContact O-N 3.04Å; V152-S156 PolarHBondContact O-N 2.94Å; V152-S156 VanDerWaalsContact O-N 3.17Å; V152-S156 PolarHBondContact O-OG 3.16Å
153	Q	58.7	Low	59.2	Low	76 Å²	76	63.7 Å²	63.7	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-68.4	-35.6	179.5	-169.1	163.2	1.6	0	0	111.4	Y149 A150 H155 S156 Q157	Y149-Q153 HydrophobicContact CD1-CB 4.44Å; Y149-Q153 VanDerWaalsContact CD1-OE1 3.31Å; Y149-Q153 HydrophobicContact CE1-CB 4.49Å; Y149-Q153 VanDerWaalsContact O-CB 3.25Å; Y149-Q153 WeakPolarHBondContact O-CB 3.43Å; Y149-Q153 PolarHBondContact O-N 3.19Å; A150-Q153 PolarHBondContact O-N 3Å; Q153-H155 VanDerWaalsContact C-N 3.34Å; Q153-H155 PolarHBondContact O-N 3.45Å; Q153-S156 PolarHBondContact O-N 3.37Å; Q153-Q157 HydrophobicContact CG-CG 4.27Å; Q153-Q157 WeakPolarHBondContact O-CB 3.32Å; Q153-Q157 WeakPolarHBondContact O-CG 3.46Å; Q153-Q157 PolarHBondContact O-N 3.26Å
154	T	61.2	Low	58.1	Low	36 Å²	36	63.2 Å²	63.2	22%	0.221	31%	0.306	C	S	.	.	H	α-helix	trans	-57.1	-47.2	174.1	-55.4	0	0	0	0	110.8	A150 E151 V152 S156 Q157 I158	A150-T154 WeakPolarHBondContact O-CB 3.5Å; A150-T154 PolarHBondContact O-N 3.03Å; A150-T154 PolarHBondContact O-OG1 3Å; E151-T154 PolarHBondContact O-N 2.84Å; V152-T154 VanDerWaalsContact C-N 3.34Å; T154-S156 PolarHBondContact O-N 2.91Å; T154-Q157 PolarHBondContact O-N 2.88Å; T154-I158 HydrophobicContact CG2-CD1 3.82Å; T154-I158 HydrophobicContact CG2-CG1 4.42Å; T154-I158 WeakPolarHBondContact O-CB 3.49Å; T154-I158 VanDerWaalsContact O-CG1 3.22Å; T154-I158 WeakPolarHBondContact O-CG1 3.33Å; T154-I158 PolarHBondContact O-N 2.79Å
155	H	56.6	Low	57	Low	24 Å²	24	65.1 Å²	65.1	11%	0.111	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-40.4	177.5	-73.4	71.3	0	0	0	112.5	K70 F139 E151 V152 Q153 Q157 I158 I159	K70-H155 HydrophobicContact CB-CB 3.84Å; F139-H155 AromaticContact CD2-CE1 3.99Å; E151-H155 PolarHBondContact O-N 3.12Å; E151-H155 PolarHBondContact O-ND1 2.91Å; V152-H155 PolarHBondContact O-N 3.04Å; Q153-H155 VanDerWaalsContact C-N 3.34Å; Q153-H155 PolarHBondContact O-N 3.45Å; H155-Q157 VanDerWaalsContact C-N 3.34Å; H155-I158 PolarHBondContact O-N 2.83Å; H155-I159 WeakPolarHBondContact O-CD1 3.45Å; H155-I159 VanDerWaalsContact O-CG1 3.31Å; H155-I159 WeakPolarHBondContact O-CG1 3.34Å; H155-I159 PolarHBondContact O-N 3.26Å; H155-I159 VanDerWaalsContact O-N 3.09Å
156	S	55.8	Low	56.2	Low	37 Å²	37	55.7 Å²	55.7	26%	0.259	28%	0.277	S	S	.	.	H	α-helix	trans	-65.1	-39.5	176.7	-59.1	0	0	0	0	112	K70 V152 Q153 T154 L160	K70-S156 VanDerWaalsContact CD-OG 3.28Å; K70-S156 WeakPolarHBondContact CD-OG 3.43Å; K70-S156 WeakPolarHBondContact CE-OG 3.4Å; K70-S156 WeakPolarHBondContact CG-OG 3.33Å; V152-S156 PolarHBondContact O-N 2.94Å; V152-S156 VanDerWaalsContact O-N 3.17Å; V152-S156 PolarHBondContact O-OG 3.16Å; Q153-S156 PolarHBondContact O-N 3.37Å; T154-S156 PolarHBondContact O-N 2.91Å; S156-L160 WeakPolarHBondContact O-CB 3.44Å; S156-L160 PolarHBondContact O-N 3.27Å; S156-L160 VanDerWaalsContact O-N 3.11Å
157	Q	55	Low	55.4	Low	40 Å²	40	55.3 Å²	55.3	19%	0.187	28%	0.276	C	S	.	.	H	α-helix	trans	-70.8	-40	177.8	-77	179.3	-2.5	0	0	111.7	Q153 T154 H155 L160 L161 G192	Q153-Q157 HydrophobicContact CG-CG 4.27Å; Q153-Q157 WeakPolarHBondContact O-CB 3.32Å; Q153-Q157 WeakPolarHBondContact O-CG 3.46Å; Q153-Q157 PolarHBondContact O-N 3.26Å; T154-Q157 PolarHBondContact O-N 2.88Å; H155-Q157 VanDerWaalsContact C-N 3.34Å; Q157-L160 PolarHBondContact O-N 3.47Å; Q157-L161 VanDerWaalsContact O-CB 3.29Å; Q157-L161 WeakPolarHBondContact O-CB 3.43Å; Q157-L161 PolarHBondContact O-N 3.46Å; Q157-G192 VanDerWaalsContact CD-CA 3.43Å; Q157-G192 PolarHBondContact NE2-O 2.84Å; Q157-G192 VanDerWaalsContact NE2-O 3.07Å; Q157-G192 VanDerWaalsContact OE1-CA 3.22Å
158	I	60.5	Low	54.6	Low	58 Å²	58	56.2 Å²	56.2	30%	0.297	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-45	175.4	-69.1	164.7	0	0	0	110.7	H74 T154 H155 L160 L161 L162	H74-I158 WeakPolarHBondContact CE1-CG2 3.45Å; H74-I158 WeakPolarHBondContact NE2-CG2 3.35Å; T154-I158 HydrophobicContact CG2-CD1 3.82Å; T154-I158 HydrophobicContact CG2-CG1 4.42Å; T154-I158 WeakPolarHBondContact O-CB 3.49Å; T154-I158 VanDerWaalsContact O-CG1 3.22Å; T154-I158 WeakPolarHBondContact O-CG1 3.33Å; T154-I158 PolarHBondContact O-N 2.79Å; H155-I158 PolarHBondContact O-N 2.83Å; I158-L160 VanDerWaalsContact C-N 3.31Å; I158-L160 PolarHBondContact O-N 3.41Å; I158-L161 PolarHBondContact O-N 3.37Å; I158-L162 HydrophobicContact CG2-CD1 3.57Å; I158-L162 HydrophobicContact CG2-CG 4.13Å; I158-L162 VanDerWaalsContact O-CB 3.31Å; I158-L162 WeakPolarHBondContact O-CB 2.88Å; I158-L162 VanDerWaalsContact O-CG 3.27Å; I158-L162 WeakPolarHBondContact O-CG 3.4Å; I158-L162 PolarHBondContact O-N 2.97Å
159	I	58	Low	53.3	Low	9 Å²	9	56.6 Å²	56.6	5%	0.046	29%	0.287	C	S	.	.	H	α-helix	trans	-58	-47.4	175.7	-67.9	162.3	0	0	0	110.4	K70 Q73 H74 L77 H155 L162 Q163	K70-I159 HydrophobicContact CD-CD1 4.27Å; K70-I159 WeakPolarHBondContact O-CD1 3.09Å; Q73-I159 HydrophobicContact CB-CD1 3.71Å; H74-I159 HydrophobicContact CB-CD1 4.09Å; H74-I159 HydrophobicContact CB-CG1 3.83Å; L77-I159 HydrophobicContact CD2-CG2 4.23Å; H155-I159 WeakPolarHBondContact O-CD1 3.45Å; H155-I159 VanDerWaalsContact O-CG1 3.31Å; H155-I159 WeakPolarHBondContact O-CG1 3.34Å; H155-I159 PolarHBondContact O-N 3.26Å; H155-I159 VanDerWaalsContact O-N 3.09Å; I159-L162 PolarHBondContact O-N 3.02Å; I159-Q163 HydrophobicContact CG2-CG 4.45Å; I159-Q163 WeakPolarHBondContact O-CB 3.5Å; I159-Q163 VanDerWaalsContact O-CG 3.3Å; I159-Q163 WeakPolarHBondContact O-CG 3.1Å; I159-Q163 PolarHBondContact O-N 2.83Å
160	L	54.4	Low	52.3	Low	43 Å²	43	56.8 Å²	56.8	23%	0.225	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-48.8	-179.8	-163.5	79.9	0	0	0	110.7	S156 Q157 I158 L162 Q163 I164 Y196 V199	S156-L160 WeakPolarHBondContact O-CB 3.44Å; S156-L160 PolarHBondContact O-N 3.27Å; S156-L160 VanDerWaalsContact O-N 3.11Å; Q157-L160 PolarHBondContact O-N 3.47Å; I158-L160 VanDerWaalsContact C-N 3.31Å; I158-L160 PolarHBondContact O-N 3.41Å; L160-L162 PolarHBondContact O-N 3.25Å; L160-Q163 WeakPolarHBondContact O-CB 3.33Å; L160-Q163 PolarHBondContact O-N 3.16Å; L160-Q163 VanDerWaalsContact O-N 3.16Å; L160-I164 HydrophobicContact CD2-CD1 4.36Å; L160-I164 HydrophobicContact CG-CD1 3.9Å; L160-I164 WeakPolarHBondContact O-CD1 3.32Å; L160-I164 WeakPolarHBondContact O-CG1 3.14Å; L160-I164 PolarHBondContact O-N 3.47Å; L160-Y196 HydrophobicContact CD2-CD2 4.14Å; L160-Y196 HydrophobicContact CD2-CE2 4.46Å; L160-V199 HydrophobicContact CD2-CG1 3.94Å; L160-V199 HydrophobicContact CG-CG1 4.27Å
161	L	54.7	Low	51.2	Low	62 Å²	62	62.7 Å²	62.7	33%	0.325	32%	0.32	S	S	.	.	H	α-helix	trans	-56.8	-48.2	176.6	-106.6	143.6	0	0	0	111.1	Q157 I158 Q163 I164 T165 F195	Q157-L161 VanDerWaalsContact O-CB 3.29Å; Q157-L161 WeakPolarHBondContact O-CB 3.43Å; Q157-L161 PolarHBondContact O-N 3.46Å; I158-L161 PolarHBondContact O-N 3.37Å; L161-Q163 PolarHBondContact O-N 3.27Å; L161-I164 PolarHBondContact O-N 3.12Å; L161-T165 WeakPolarHBondContact O-CB 2.99Å; L161-T165 PolarHBondContact O-N 3.12Å; L161-T165 PolarHBondContact O-OG1 3.4Å; L161-F195 HydrophobicContact CD1-CD1 4.4Å; L161-F195 HydrophobicContact CD1-CE1 4.35Å; L161-F195 HydrophobicContact CD2-CD1 4.46Å; L161-F195 HydrophobicContact CD2-CE1 3.67Å; L161-F195 HydrophobicContact CD2-CZ 3.76Å; L161-F195 HydrophobicContact CG-CD1 4.15Å; L161-F195 HydrophobicContact CG-CE1 3.65Å; L161-F195 HydrophobicContact CG-CZ 4.27Å
162	L	56	Low	50.2	Low	15 Å²	15	60.5 Å²	60.5	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-61.5	-44.7	176.5	-73.1	167.4	0	0	0	110.5	H74 L77 I81 I158 I159 L160 I164 L166 L176	H74-L162 WeakPolarHBondContact NE2-CD1 3.21Å; L77-L162 HydrophobicContact CD2-CB 3.54Å; L77-L162 HydrophobicContact CD2-CD1 4.1Å; L77-L162 HydrophobicContact CD2-CG 4.49Å; L77-L162 HydrophobicContact CG-CB 4.41Å; I81-L162 HydrophobicContact CD1-CD2 4.32Å; I158-L162 HydrophobicContact CG2-CD1 3.57Å; I158-L162 HydrophobicContact CG2-CG 4.13Å; I158-L162 VanDerWaalsContact O-CB 3.31Å; I158-L162 WeakPolarHBondContact O-CB 2.88Å; I158-L162 VanDerWaalsContact O-CG 3.27Å; I158-L162 WeakPolarHBondContact O-CG 3.4Å; I158-L162 PolarHBondContact O-N 2.97Å; I159-L162 PolarHBondContact O-N 3.02Å; L160-L162 PolarHBondContact O-N 3.25Å; L162-I164 VanDerWaalsContact C-N 3.31Å; L162-I164 PolarHBondContact O-N 3.32Å; L162-L166 HydrophobicContact CB-CD1 4.01Å; L162-L166 HydrophobicContact CD2-CD1 3.7Å; L162-L166 HydrophobicContact CD2-CG 4.45Å; L162-L166 HydrophobicContact CG-CD1 4.48Å; L162-L166 WeakPolarHBondContact O-CA 3.4Å; L162-L166 WeakPolarHBondContact O-CB 3.39Å; L162-L166 WeakPolarHBondContact O-CD1 3.38Å; L162-L166 WeakPolarHBondContact O-CG 3.16Å; L162-L166 PolarHBondContact O-N 3.49Å; L162-L176 HydrophobicContact CD2-CD1 4.2Å; L162-L176 HydrophobicContact CD2-CD2 3.96Å
163	Q	55.2	Low	49.2	Very low	68 Å²	68	63.9 Å²	63.9	32%	0.318	33%	0.329	S	S	.	.	H	α-helix	trans	-59.7	-37.8	176.1	-76.3	178.3	-51.8	0	0	113.5	L77 Y89 Q90 I159 L160 L161	L77-Q163 HydrophobicContact CD2-CG 4.22Å; Y89-Q163 HydrophobicContact CD1-CG 3.95Å; Y89-Q163 HydrophobicContact CE1-CG 3.66Å; Q90-Q163 PolarHBondContact O-NE2 2.95Å; I159-Q163 HydrophobicContact CG2-CG 4.45Å; I159-Q163 WeakPolarHBondContact O-CB 3.5Å; I159-Q163 VanDerWaalsContact O-CG 3.3Å; I159-Q163 WeakPolarHBondContact O-CG 3.1Å; I159-Q163 PolarHBondContact O-N 2.83Å; L160-Q163 WeakPolarHBondContact O-CB 3.33Å; L160-Q163 PolarHBondContact O-N 3.16Å; L160-Q163 VanDerWaalsContact O-N 3.16Å; L161-Q163 PolarHBondContact O-N 3.27Å
164	I	47.3	Very low	48.1	Very low	55 Å²	55	66.6 Å²	66.6	28%	0.282	35%	0.346	S	S	.	.	H	α-helix	trans	-80.4	-51.6	-178	-59	146.9	0	0	0	111.4	L160 L161 L162 L166 R167 F195 V199	L160-I164 HydrophobicContact CD2-CD1 4.36Å; L160-I164 HydrophobicContact CG-CD1 3.9Å; L160-I164 WeakPolarHBondContact O-CD1 3.32Å; L160-I164 WeakPolarHBondContact O-CG1 3.14Å; L160-I164 PolarHBondContact O-N 3.47Å; L161-I164 PolarHBondContact O-N 3.12Å; L162-I164 VanDerWaalsContact C-N 3.31Å; L162-I164 PolarHBondContact O-N 3.32Å; I164-L166 PolarHBondContact O-N 2.85Å; I164-R167 PolarHBondContact O-N 3.14Å; I164-F195 HydrophobicContact CD1-CE1 4.17Å; I164-V199 HydrophobicContact CD1-CB 3.95Å; I164-V199 HydrophobicContact CD1-CG1 3.38Å; I164-V199 HydrophobicContact CD1-CG2 3.27Å; I164-V199 HydrophobicContact CG1-CG1 3.93Å; I164-V199 HydrophobicContact CG1-CG2 4.3Å
165	T	43.4	Very low	46.7	Very low	84 Å²	84	71.6 Å²	71.6	52%	0.515	37%	0.367	S	S	.	.	H	α-helix	trans	-64.6	-29.8	-175.9	-43.5	0	0	0	0	109.8	L161	L161-T165 WeakPolarHBondContact O-CB 2.99Å; L161-T165 PolarHBondContact O-N 3.12Å; L161-T165 PolarHBondContact O-OG1 3.4Å
166	L	46	Very low	45.9	Very low	8 Å²	8	71.9 Å²	71.9	4%	0.042	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	44.3	-178.2	-51.8	171.4	0	0	0	113.5	I81 C86 L162 I164 C168 L176	I81-L166 HydrophobicContact CD1-CD1 3.27Å; I81-L166 HydrophobicContact CG1-CD1 3.81Å; C86-L166 WeakPolarHBondContact SG-CB 3.38Å; C86-L166 PolarHBondContact SG-O 3.35Å; L162-L166 HydrophobicContact CB-CD1 4.01Å; L162-L166 HydrophobicContact CD2-CD1 3.7Å; L162-L166 HydrophobicContact CD2-CG 4.45Å; L162-L166 HydrophobicContact CG-CD1 4.48Å; L162-L166 WeakPolarHBondContact O-CA 3.4Å; L162-L166 WeakPolarHBondContact O-CB 3.39Å; L162-L166 WeakPolarHBondContact O-CD1 3.38Å; L162-L166 WeakPolarHBondContact O-CG 3.16Å; L162-L166 PolarHBondContact O-N 3.49Å; I164-L166 PolarHBondContact O-N 2.85Å; L166-C168 PolarHBondContact O-N 3.07Å; L166-L176 HydrophobicContact CD1-CD2 3.76Å; L166-L176 HydrophobicContact CD2-CD1 4.09Å; L166-L176 HydrophobicContact CD2-CD2 3.74Å; L166-L176 HydrophobicContact CD2-CG 4.41Å; L166-L176 HydrophobicContact CG-CD2 4.32Å
167	R	47.1	Very low	45	Very low	184 Å²	184	77.6 Å²	77.6	69%	0.694	39%	0.389	S	S	*	.	S	Bend	trans	-64.1	68.5	140.8	-76	-167.8	-175.3	-165.3	3.8	108.2	I164 S169	I164-R167 PolarHBondContact O-N 3.14Å; R167-S169 VanDerWaalsContact C-N 3.34Å; R167-S169 PolarHBondContact O-N 2.91Å
168	C	43.5	Very low	44	Very low	25 Å²	25	81.7 Å²	81.7	17%	0.169	41%	0.408	C	S	.	.			trans	-47.2	91.6	-161.5	-91.4	0	0	0	0	110.5	C86 D87 L166	C86-C168 HydrophobicContact CB-CB 4.05Å; C86-C168 WeakPolarHBondContact CB-SG 3.27Å; C86-C168 WeakPolarHBondContact SG-CB 3.12Å; C86-C168 CovalentContact SG-SG 2.05Å; C86-C168 PolarHBondContact SG-SG 2.99Å; D87-C168 HydrophobicContact CB-CB 4.48Å; L166-C168 PolarHBondContact O-N 3.07Å
169	S	36.5	Very low	42.7	Very low	77 Å²	77	84 Å²	84	54%	0.538	42%	0.417	S	S	.	.			trans	-66.4	135	156.4	159.7	0	0	0	0	106.2	R167 H171 S172	R167-S169 VanDerWaalsContact C-N 3.34Å; R167-S169 PolarHBondContact O-N 2.91Å; S169-H171 PolarHBondContact O-N 3.01Å; S169-S172 PolarHBondContact O-N 2.85Å; S169-S172 PolarHBondContact O-OG 2.92Å
170	D	35.7	Very low	41.7	Very low	166 Å²	166	86.9 Å²	86.9	89%	0.888	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-19.3	-177.1	-74.4	-40	0	0	0	113.6
171	H	33.3	Very low	40.6	Very low	162 Å²	162	92.1 Å²	92.1	75%	0.75	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-22.3	179	-136.6	-25.4	0	0	0	114.8	S169	S169-H171 PolarHBondContact O-N 3.01Å
172	S	37.6	Very low	39.3	Very low	32 Å²	32	98.7 Å²	98.7	22%	0.224	48%	0.476	C	S	.	.	H	α-helix	trans	-86.9	-13.4	-169.1	72.8	0	0	0	0	115.3	S169 L176	S169-S172 PolarHBondContact O-N 2.85Å; S169-S172 PolarHBondContact O-OG 2.92Å; S172-L176 VanDerWaalsContact O-CB 3.29Å; S172-L176 WeakPolarHBondContact O-CB 3.48Å; S172-L176 PolarHBondContact O-N 3.23Å
173	Q	36.5	Very low	38.1	Very low	80 Å²	80	101.9 Å²	101.9	37%	0.374	49%	0.493	S	S	.	.	H	α-helix	trans	-72.1	-34.6	-174.6	-71.2	-157.4	-3	0	0	114	K177	Q173-K177 PolarHBondContact O-N 2.84Å
174	N	35.5	Very low	37	Very low	134 Å²	134	107 Å²	107	72%	0.717	52%	0.515	S	S	*	.	H	α-helix	trans	-76.8	-35.7	-178.7	-79.4	-21.8	0	0	0	112.9
175	E	33.3	Very low	36	Very low	141 Å²	141	115.7 Å²	115.7	66%	0.659	54%	0.544	S	S	*	.	H	α-helix	trans	-74.7	-35.3	176.3	-71	-162.9	156.9	0	0	112.3	K177 H178 H179	E175-K177 VanDerWaalsContact C-N 3.31Å; E175-K177 PolarHBondContact O-N 3.34Å; E175-H178 PolarHBondContact O-N 3.24Å; E175-H179 PolarHBondContact O-N 3.41Å
176	L	38.2	Very low	35.1	Very low	30 Å²	30	117.9 Å²	117.9	16%	0.157	55%	0.552	C	S	.	*	H	α-helix	trans	-67.5	-32.3	179.4	-158.3	86.6	0	0	0	112.7	I81 L162 L166 S172 H178 H179 L180	I81-L176 HydrophobicContact CD1-CD2 4.32Å; I81-L176 HydrophobicContact CG2-CD2 4.14Å; L162-L176 HydrophobicContact CD2-CD1 4.2Å; L162-L176 HydrophobicContact CD2-CD2 3.96Å; L166-L176 HydrophobicContact CD1-CD2 3.76Å; L166-L176 HydrophobicContact CD2-CD1 4.09Å; L166-L176 HydrophobicContact CD2-CD2 3.74Å; L166-L176 HydrophobicContact CD2-CG 4.41Å; L166-L176 HydrophobicContact CG-CD2 4.32Å; S172-L176 VanDerWaalsContact O-CB 3.29Å; S172-L176 WeakPolarHBondContact O-CB 3.48Å; S172-L176 PolarHBondContact O-N 3.23Å; L176-H178 PolarHBondContact O-N 2.74Å; L176-H179 PolarHBondContact O-N 2.8Å; L176-L180 HydrophobicContact CD2-CD1 3.78Å; L176-L180 HydrophobicContact CG-CD1 4.01Å; L176-L180 HydrophobicContact CG-CG 4.41Å; L176-L180 WeakPolarHBondContact O-CB 3.24Å; L176-L180 PolarHBondContact O-N 3.43Å
177	K	37.2	Very low	34.4	Very low	157 Å²	157	121 Å²	121	68%	0.683	58%	0.575	S	S	*	*	H	α-helix	trans	-62	-34.7	176.2	-155.7	177.2	-175.5	-178.9	0	111.5	Q173 E175	Q173-K177 PolarHBondContact O-N 2.84Å; E175-K177 VanDerWaalsContact C-N 3.31Å; E175-K177 PolarHBondContact O-N 3.34Å
178	H	34.1	Very low	33.5	Very low	125 Å²	125	115.4 Å²	115.4	58%	0.579	57%	0.567	S	S	*	*	H	α-helix	trans	-76.6	-38.2	173	-86.3	-63.2	0	0	0	112.8	E175 L176 E181 W182	E175-H178 PolarHBondContact O-N 3.24Å; L176-H178 PolarHBondContact O-N 2.74Å; H178-E181 PolarHBondContact O-N 2.82Å; H178-W182 VanDerWaalsContact O-CD1 3.26Å; H178-W182 PolarHBondContact O-N 3.3Å
179	H	34.5	Very low	32.7	Very low	107 Å²	107	122 Å²	122	50%	0.495	60%	0.6	S	S	.	*	H	α-helix	trans	-70.1	-35.3	178	-88.6	-71.7	0	0	0	113.9	E175 L176 E181 W182 D183	E175-H179 PolarHBondContact O-N 3.41Å; L176-H179 PolarHBondContact O-N 2.8Å; H179-E181 PolarHBondContact O-N 2.03Å; H179-W182 PolarHBondContact O-N 2.63Å; H179-W182 VanDerWaalsContact O-N 3.07Å; H179-D183 IonicContact CG-OD2 3.78Å; H179-D183 IonicContact ND1-OD2 2.81Å; H179-D183 PolarHBondContact ND1-OD2 3.42Å; H179-D183 PolarHBondContact O-N 3.16Å
180	L	36.1	Very low	32.4	Very low	69 Å²	69	123.5 Å²	123.5	36%	0.361	61%	0.61	S	S	.	*	H	α-helix	trans	-66.1	-23.9	174.7	-80.9	161.2	0	0	0	113.1	L176	L176-L180 HydrophobicContact CD2-CD1 3.78Å; L176-L180 HydrophobicContact CG-CD1 4.01Å; L176-L180 HydrophobicContact CG-CG 4.41Å; L176-L180 WeakPolarHBondContact O-CB 3.24Å; L176-L180 PolarHBondContact O-N 3.43Å
181	E	32.3	Very low	32.4	Very low	154 Å²	154	119.2 Å²	119.2	72%	0.72	59%	0.59	S	S	*	*	H	α-helix	trans	-79	-20.9	172.3	-103.5	-179.2	165.7	0	0	113.1	H178 H179	H178-E181 PolarHBondContact O-N 2.82Å; H179-E181 PolarHBondContact O-N 2.03Å
182	W	26.7	Very low	32.3	Very low	199 Å²	199	112.2 Å²	112.2	75%	0.754	56%	0.562	S	S	*	*	H	α-helix	trans	-113.7	-21.4	-169	-80.3	88.2	0	0	0	116.1	H178 H179 F184	H178-W182 VanDerWaalsContact O-CD1 3.26Å; H178-W182 PolarHBondContact O-N 3.3Å; H179-W182 PolarHBondContact O-N 2.63Å; H179-W182 VanDerWaalsContact O-N 3.07Å; W182-F184 PolarHBondContact O-N 3.42Å
183	D	30.2	Very low	32	Very low	82 Å²	82	115.1 Å²	115.1	44%	0.439	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-93.4	23.4	-167.5	-84.6	-41.2	0	0	0	117.3	H179 R185	H179-D183 IonicContact CG-OD2 3.78Å; H179-D183 IonicContact ND1-OD2 2.81Å; H179-D183 PolarHBondContact ND1-OD2 3.42Å; H179-D183 PolarHBondContact O-N 3.16Å; D183-R185 PolarHBondContact O-N 3.13Å; D183-R185 VanDerWaalsContact O-N 3.13Å
184	F	31.8	Very low	31.7	Very low	175 Å²	175	118.7 Å²	118.7	77%	0.768	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-72.4	0.3	171.5	-145	-94.8	0	0	0	113.8	A138 W182	A138-F184 HydrophobicContact CB-CE2 4.4Å; A138-F184 HydrophobicContact CB-CZ 4.02Å; W182-F184 PolarHBondContact O-N 3.42Å
185	R	27.1	Very low	31.8	Very low	238 Å²	238	116 Å²	116	90%	0.898	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-115.3	-6.8	-174.5	-79	-170.8	165.3	-163.3	-3.2	116.7	D183	D183-R185 PolarHBondContact O-N 3.13Å; D183-R185 VanDerWaalsContact O-N 3.13Å
186	L	24.4	Very low	31.9	Very low	131 Å²	131	114.1 Å²	114.1	69%	0.686	56%	0.557	S	S	*	*	S	Bend	trans	-141.6	100.5	-175.7	-76.7	148.9	0	0	0	108.3
187	S	30.9	Very low	31.8	Very low	74 Å²	74	115.4 Å²	115.4	52%	0.517	56%	0.564	S	S	.	*				173	107.6	70	39.2	0	0	0	0	108.2
188	A	27.6	Very low	31.9	Very low	65 Å²	65	111.8 Å²	111.8	54%	0.537	56%	0.555	S	S	.	*	S	Bend	trans	-90.2	-0.2	-176.7	0	0	0	0	0	114.5
189	L	28.2	Very low	32.1	Very low	165 Å²	165	106.1 Å²	106.1	86%	0.864	53%	0.529	S	S	*	.	S	Bend	trans	-143.1	-6.6	-159.4	-75.3	169	0	0	0	120
190	S	29.6	Very low	32.3	Very low	107 Å²	107	103.6 Å²	103.6	75%	0.748	52%	0.519	S	S	*	.	S	Bend	trans	-144.8	-17.6	-177.3	68.5	0	0	0	0	118.9
191	V	34.5	Very low	32.2	Very low	76 Å²	76	107.2 Å²	107.2	46%	0.461	53%	0.534	S	S	.	.	S	Bend	trans	-87	-19.8	-177.8	-174	0	0	0	0	112.2	F193 F195	V191-F193 PolarHBondContact O-N 2.85Å; V191-F195 HydrophobicContact CG1-CB 4.46Å; V191-F195 VanDerWaalsContact O-CB 3.23Å; V191-F195 WeakPolarHBondContact O-CB 3.13Å; V191-F195 PolarHBondContact O-N 3.39Å
192	G	31.5	Very low	32.3	Very low	16 Å²	16	104.7 Å²	104.7	17%	0.165	53%	0.525	C	S	.	.	H	α-helix	trans	-70.9	-23.8	-166.1	0	0	0	0	0	117.5	Q157 Y196	Q157-G192 VanDerWaalsContact CD-CA 3.43Å; Q157-G192 PolarHBondContact NE2-O 2.84Å; Q157-G192 VanDerWaalsContact NE2-O 3.07Å; Q157-G192 VanDerWaalsContact OE1-CA 3.22Å; G192-Y196 WeakPolarHBondContact O-CB 3.22Å
193	F	32.2	Very low	32.6	Very low	93 Å²	93	100 Å²	100	41%	0.408	51%	0.514	S	S	.	.	H	α-helix	trans	-91.7	-49.5	-173	-161.1	-98.5	0	0	0	112.9	V191 F195 Y196 N197 F262	V191-F193 PolarHBondContact O-N 2.85Å; F193-F195 PolarHBondContact O-N 3.49Å; F193-Y196 PolarHBondContact O-N 2.76Å; F193-N197 PolarHBondContact O-N 3.06Å; F193-F262 WeakPolarHBondContact CE1-O 3.18Å; F193-F262 HydrophobicContact CE2-CB 4.13Å; F193-F262 HydrophobicContact CZ-CB 4.16Å; F193-F262 WeakPolarHBondContact CZ-O 3.26Å
194	H	30.7	Very low	32.8	Very low	155 Å²	155	102.5 Å²	102.5	72%	0.718	53%	0.527	S	S	*	.	H	α-helix	trans	-70.1	-31.4	177.5	-87.9	-48.5	0	0	0	113.6	T198	H194-T198 PolarHBondContact O-N 3.34Å; H194-T198 PolarHBondContact O-OG1 2.7Å
195	F	37.8	Very low	32.8	Very low	78 Å²	78	98.1 Å²	98.1	34%	0.342	52%	0.523	S	S	.	.	H	α-helix	trans	-70	-36.1	176.4	-155.4	-95.4	0	0	0	111.3	L161 I164 V191 F193 T198 V199	L161-F195 HydrophobicContact CD1-CD1 4.4Å; L161-F195 HydrophobicContact CD1-CE1 4.35Å; L161-F195 HydrophobicContact CD2-CD1 4.46Å; L161-F195 HydrophobicContact CD2-CE1 3.67Å; L161-F195 HydrophobicContact CD2-CZ 3.76Å; L161-F195 HydrophobicContact CG-CD1 4.15Å; L161-F195 HydrophobicContact CG-CE1 3.65Å; L161-F195 HydrophobicContact CG-CZ 4.27Å; I164-F195 HydrophobicContact CD1-CE1 4.17Å; V191-F195 HydrophobicContact CG1-CB 4.46Å; V191-F195 VanDerWaalsContact O-CB 3.23Å; V191-F195 WeakPolarHBondContact O-CB 3.13Å; V191-F195 PolarHBondContact O-N 3.39Å; F193-F195 PolarHBondContact O-N 3.49Å; F195-T198 PolarHBondContact O-N 3.15Å; F195-V199 HydrophobicContact CD1-CG2 3.77Å; F195-V199 HydrophobicContact CE1-CG2 3.72Å; F195-V199 WeakPolarHBondContact O-CB 3.45Å; F195-V199 WeakPolarHBondContact O-CG2 3.37Å; F195-V199 PolarHBondContact O-N 3.06Å
196	Y	35.5	Very low	32.9	Very low	101 Å²	101	89.8 Å²	89.8	40%	0.396	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-46.5	179.1	-172.6	-98.1	0	0	0	112.8	L160 G192 F193 T198 V199 L200	L160-Y196 HydrophobicContact CD2-CD2 4.14Å; L160-Y196 HydrophobicContact CD2-CE2 4.46Å; G192-Y196 WeakPolarHBondContact O-CB 3.22Å; F193-Y196 PolarHBondContact O-N 2.76Å; Y196-T198 PolarHBondContact O-N 2.99Å; Y196-V199 PolarHBondContact O-N 2.96Å; Y196-L200 HydrophobicContact CE1-CD1 4.08Å; Y196-L200 PolarHBondContact O-N 3.47Å
197	N	36.1	Very low	32.9	Very low	57 Å²	57	87.3 Å²	87.3	31%	0.305	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-37.2	178.6	-83.4	-17.6	0	0	0	112.8	F193 V199 L200 Q201	F193-N197 PolarHBondContact O-N 3.06Å; N197-V199 VanDerWaalsContact C-N 3.34Å; N197-V199 PolarHBondContact O-N 3.22Å; N197-L200 PolarHBondContact O-N 3.48Å; N197-Q201 WeakPolarHBondContact O-CG 3.4Å; N197-Q201 PolarHBondContact O-N 2.87Å
198	T	38.9	Very low	32.6	Very low	80 Å²	80	87 Å²	87	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-66.6	-37.9	177.5	-53.3	0	0	0	0	111.5	H194 F195 Y196 L202	H194-T198 PolarHBondContact O-N 3.34Å; H194-T198 PolarHBondContact O-OG1 2.7Å; F195-T198 PolarHBondContact O-N 3.15Å; Y196-T198 PolarHBondContact O-N 2.99Å; T198-L202 PolarHBondContact O-N 2.75Å
199	V	38.4	Very low	32.5	Very low	6 Å²	6	89.2 Å²	89.2	4%	0.036	53%	0.525	C	S	.	.	H	α-helix	trans	-71.6	-40.4	177.2	166.9	0	0	0	0	112.3	L160 I164 F195 Y196 N197 Q201 L202 L203	L160-V199 HydrophobicContact CD2-CG1 3.94Å; L160-V199 HydrophobicContact CG-CG1 4.27Å; I164-V199 HydrophobicContact CD1-CB 3.95Å; I164-V199 HydrophobicContact CD1-CG1 3.38Å; I164-V199 HydrophobicContact CD1-CG2 3.27Å; I164-V199 HydrophobicContact CG1-CG1 3.93Å; I164-V199 HydrophobicContact CG1-CG2 4.3Å; F195-V199 HydrophobicContact CD1-CG2 3.77Å; F195-V199 HydrophobicContact CE1-CG2 3.72Å; F195-V199 WeakPolarHBondContact O-CB 3.45Å; F195-V199 WeakPolarHBondContact O-CG2 3.37Å; F195-V199 PolarHBondContact O-N 3.06Å; Y196-V199 PolarHBondContact O-N 2.96Å; N197-V199 VanDerWaalsContact C-N 3.34Å; N197-V199 PolarHBondContact O-N 3.22Å; V199-Q201 VanDerWaalsContact C-N 3.26Å; V199-Q201 PolarHBondContact O-N 2.85Å; V199-L202 PolarHBondContact O-N 3.46Å; V199-L202 VanDerWaalsContact O-N 3.15Å; V199-L203 HydrophobicContact CG1-CD1 3.88Å; V199-L203 HydrophobicContact CG1-CG 4.45Å; V199-L203 PolarHBondContact O-N 3.46Å
200	L	37	Very low	32.3	Very low	54 Å²	54	90.8 Å²	90.8	28%	0.283	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-37.7	177.9	-143	86.3	0	0	0	110.9	Y196 N197 N204	Y196-L200 HydrophobicContact CE1-CD1 4.08Å; Y196-L200 PolarHBondContact O-N 3.47Å; N197-L200 PolarHBondContact O-N 3.48Å; L200-N204 WeakPolarHBondContact O-CB 3.22Å; L200-N204 PolarHBondContact O-N 3.32Å; L200-N204 PolarHBondContact O-ND2 3.4Å
201	Q	35.9	Very low	32.2	Very low	146 Å²	146	88.5 Å²	88.5	68%	0.682	51%	0.508	S	S	*	.	H	α-helix	trans	-66	-39.8	173	-73	-175.1	-4.1	0	0	112.4	N197 V199 N204 A205	N197-Q201 WeakPolarHBondContact O-CG 3.4Å; N197-Q201 PolarHBondContact O-N 2.87Å; V199-Q201 VanDerWaalsContact C-N 3.26Å; V199-Q201 PolarHBondContact O-N 2.85Å; Q201-N204 PolarHBondContact O-N 3.3Å; Q201-A205 WeakPolarHBondContact O-CB 3.27Å; Q201-A205 PolarHBondContact O-N 3.37Å
202	L	33.5	Very low	31.8	Very low	101 Å²	101	91.7 Å²	91.7	53%	0.529	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-39.1	175.6	-104.9	146.2	0	0	0	113	T198 V199 A205 V206	T198-L202 PolarHBondContact O-N 2.75Å; V199-L202 PolarHBondContact O-N 3.46Å; V199-L202 VanDerWaalsContact O-N 3.15Å; L202-A205 PolarHBondContact O-N 2.78Å; L202-V206 WeakPolarHBondContact O-CG2 3.46Å; L202-V206 PolarHBondContact O-N 2.83Å
203	L	33.4	Very low	31.6	Very low	101 Å²	101	100.5 Å²	100.5	53%	0.529	55%	0.546	S	S	.	.	H	α-helix	trans	-71.1	-31.2	176	-76.7	167	0	0	0	112.7	V199 V206	V199-L203 HydrophobicContact CG1-CD1 3.88Å; V199-L203 HydrophobicContact CG1-CG 4.45Å; V199-L203 PolarHBondContact O-N 3.46Å; L203-V206 VanDerWaalsContact O-O 3.09Å
204	N	33.3	Very low	31.4	Very low	133 Å²	133	103.9 Å²	103.9	71%	0.711	56%	0.557	S	S	*	*	H	α-helix	trans	-73.8	-29.5	171.8	-76.3	-23.8	0	0	0	112.5	L200 Q201	L200-N204 WeakPolarHBondContact O-CB 3.22Å; L200-N204 PolarHBondContact O-N 3.32Å; L200-N204 PolarHBondContact O-ND2 3.4Å; Q201-N204 PolarHBondContact O-N 3.3Å
205	A	31.5	Very low	31.4	Very low	83 Å²	83	98 Å²	98	69%	0.686	53%	0.533	S	S	*	.	H	α-helix	trans	-75.5	-31.3	176.3	0	0	0	0	0	112.9	Q201 L202 G207	Q201-A205 WeakPolarHBondContact O-CB 3.27Å; Q201-A205 PolarHBondContact O-N 3.37Å; L202-A205 PolarHBondContact O-N 2.78Å; A205-G207 PolarHBondContact O-N 2.59Å
206	V	29.6	Very low	31.2	Very low	64 Å²	64	96.6 Å²	96.6	39%	0.388	53%	0.53	S	S	.	.	S	Bend	trans	-92	90.1	174.4	-174.2	0	0	0	0	108.3	L202 L203 G208	L202-V206 WeakPolarHBondContact O-CG2 3.46Å; L202-V206 PolarHBondContact O-N 2.83Å; L203-V206 VanDerWaalsContact O-O 3.09Å; V206-G208 VanDerWaalsContact C-N 3.34Å; V206-G208 PolarHBondContact O-N 2.91Å
207	G	24.4	Very low	31.2	Very low	78 Å²	78	99.6 Å²	99.6	80%	0.804	55%	0.548	S	S	*	.			trans	-53.8	90.8	175.5	0	0	0	0	0	112.6	A205 S209	A205-G207 PolarHBondContact O-N 2.59Å; G207-S209 PolarHBondContact O-N 2.89Å
208	G	25.6	Very low	31.2	Very low	68 Å²	68	99 Å²	99	70%	0.701	55%	0.547	S	S	*	.			trans	-81.4	111.8	174.8	0	0	0	0	0	110.3	V206 K210	V206-G208 VanDerWaalsContact C-N 3.34Å; V206-G208 PolarHBondContact O-N 2.91Å; G208-K210 PolarHBondContact O-N 2.79Å
209	S	24.3	Very low	31.1	Very low	111 Å²	111	97.6 Å²	97.6	78%	0.776	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-53.2	127.1	168.6	48.7	0	0	0	0	110.5	G207	G207-S209 PolarHBondContact O-N 2.89Å
210	K	25.1	Very low	31.2	Very low	198 Å²	198	97.4 Å²	97.4	86%	0.861	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-50	121.7	174.5	-72.6	177.8	179.3	173.7	0	109	G208 Q212	G208-K210 PolarHBondContact O-N 2.79Å; K210-Q212 PolarHBondContact O-N 2.84Å
211	P	27.7	Very low	31.5	Very low	60 Å²	60	100.7 Å²	100.7	39%	0.39	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-60.6	130.7	-178.6	21.5	-30.5	0	0	0	109.7	R213	P211-R213 PolarHBondContact O-N 2.87Å
212	Q	24.7	Very low	31.6	Very low	143 Å²	143	96.4 Å²	96.4	67%	0.668	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-54.5	135.8	178.2	-78.5	-170.8	-13	0	0	110.2	K210 Y214	K210-Q212 PolarHBondContact O-N 2.84Å; Q212-Y214 VanDerWaalsContact C-N 3.32Å; Q212-Y214 HydrophobicContact CB-CD2 4.12Å; Q212-Y214 HydrophobicContact CB-CE2 4.24Å; Q212-Y214 PolarHBondContact O-N 3.48Å
213	R	28.2	Very low	32.2	Very low	201 Å²	201	93.3 Å²	93.3	76%	0.758	53%	0.528	S	S	*	.			trans	-82.1	73.6	-171	-66.6	-179	179.3	179.8	-0.3	111.7	R38 P211	R38-R213 VanDerWaalsContact NH2-CA 3.34Å; P211-R213 PolarHBondContact O-N 2.87Å
214	Y	28.7	Very low	32.7	Very low	164 Å²	164	93.3 Å²	93.3	64%	0.643	53%	0.525	S	S	*	.			trans	-131.1	114.1	167.3	-57.1	-76.5	0	0	0	108.6	Q212 V216	Q212-Y214 VanDerWaalsContact C-N 3.32Å; Q212-Y214 HydrophobicContact CB-CD2 4.12Å; Q212-Y214 HydrophobicContact CB-CE2 4.24Å; Q212-Y214 PolarHBondContact O-N 3.48Å; Y214-V216 VanDerWaalsContact C-N 3.34Å; Y214-V216 PolarHBondContact O-N 2.79Å; Y214-V216 VanDerWaalsContact O-N 3.1Å
215	C	29.4	Very low	33.6	Very low	31 Å²	31	89.7 Å²	89.7	21%	0.209	51%	0.505	C	S	.	.	B	Isolated β-bridge	trans	-61.8	106.9	153	-83.6	0	0	0	0	105	E217 L225	C215-E217 PolarHBondContact O-N 2.87Å; C215-E217 VanDerWaalsContact O-N 3.11Å; C215-L225 HydrophobicContact CB-CD1 4.05Å; C215-L225 HydrophobicContact CB-CD2 4.21Å
216	V	35	Very low	34.8	Very low	48 Å²	48	91.7 Å²	91.7	29%	0.291	50%	0.499	S	S	.	.			trans	-72.7	112.8	175.9	-178.9	0	0	0	0	104.9	K37 R38 Y214 T218	K37-V216 HydrophobicContact CB-CB 4.25Å; K37-V216 HydrophobicContact CB-CG2 3.86Å; K37-V216 HydrophobicContact CD-CB 4.38Å; K37-V216 HydrophobicContact CD-CG1 4.23Å; K37-V216 HydrophobicContact CD-CG2 4.17Å; K37-V216 HydrophobicContact CG-CB 4.49Å; K37-V216 HydrophobicContact CG-CG2 3.88Å; R38-V216 PolarHBondContact O-N 3.4Å; Y214-V216 VanDerWaalsContact C-N 3.34Å; Y214-V216 PolarHBondContact O-N 2.79Å; Y214-V216 VanDerWaalsContact O-N 3.1Å; V216-T218 HydrophobicContact CG1-CG2 4.39Å; V216-T218 PolarHBondContact O-N 3.36Å; V216-T218 PolarHBondContact O-OG1 3.49Å
217	E	35.4	Very low	36.1	Very low	164 Å²	164	91.9 Å²	91.9	77%	0.766	50%	0.497	S	S	*	.			trans	-51.8	77.6	170.4	-70.9	178.6	141	0	0	110.2	C215	C215-E217 PolarHBondContact O-N 2.87Å; C215-E217 VanDerWaalsContact O-N 3.11Å
218	T	34.6	Very low	37.6	Very low	45 Å²	45	88.2 Å²	88.2	28%	0.276	46%	0.459	S	S	.	.			trans	-142.2	97.6	170.1	40	0	0	0	0	106.4	L116 V216 V220	L116-T218 VanDerWaalsContact CD1-O 3.27Å; L116-T218 WeakPolarHBondContact CD1-O 3.26Å; L116-T218 HydrophobicContact CD2-CG2 4.34Å; V216-T218 HydrophobicContact CG1-CG2 4.39Å; V216-T218 PolarHBondContact O-N 3.36Å; V216-T218 PolarHBondContact O-OG1 3.49Å; T218-V220 PolarHBondContact O-N 2.92Å
219	T	36.9	Very low	39.1	Very low	50 Å²	50	87.4 Å²	87.4	31%	0.307	44%	0.439	S	S	.	.			trans	-76.3	112.9	-169.7	51	0	0	0	0	108.6	K221 G222 I223	T219-K221 PolarHBondContact O-N 2.87Å; T219-K221 VanDerWaalsContact O-N 3.1Å; T219-G222 WeakPolarHBondContact OG1-CA 3.48Å; T219-I223 WeakPolarHBondContact CG2-O 3.4Å
220	V	40.3	Very low	40.9	Very low	2 Å²	2	86 Å²	86	1%	0.012	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	102	165.8	174.1	0	0	0	0	105.8	M41 L116 M119 Q120 T123 T218	M41-V220 HydrophobicContact CG-CG2 4.47Å; L116-V220 HydrophobicContact CD1-CG2 3.53Å; M119-V220 HydrophobicContact CB-CG2 3.94Å; Q120-V220 HydrophobicContact CB-CG1 4.33Å; Q120-V220 HydrophobicContact CG-CB 4.31Å; Q120-V220 HydrophobicContact CG-CG1 3.73Å; Q120-V220 HydrophobicContact CG-CG2 4.15Å; T123-V220 HydrophobicContact CG2-CG1 3.92Å; T123-V220 WeakPolarHBondContact OG1-CG1 3.4Å; T218-V220 PolarHBondContact O-N 2.92Å
221	K	43.4	Very low	42.9	Very low	123 Å²	123	80.7 Å²	80.7	54%	0.535	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	34.5	-173.1	-54.9	-173.5	166.8	-168.6	0	117	T219 I223	T219-K221 PolarHBondContact O-N 2.87Å; T219-K221 VanDerWaalsContact O-N 3.1Å; K221-I223 VanDerWaalsContact C-N 3.31Å; K221-I223 PolarHBondContact O-N 3.31Å
222	G	39.5	Very low	44.8	Very low	57 Å²	57	77.9 Å²	77.9	59%	0.588	39%	0.394	S	S	*	.	S	Bend	trans	73.4	12.8	163.6	0	0	0	0	0	116.8	T219 E224	T219-G222 WeakPolarHBondContact OG1-CA 3.48Å; G222-E224 PolarHBondContact O-N 3.37Å
223	I	44.4	Very low	46.2	Very low	36 Å²	36	77.3 Å²	77.3	19%	0.185	40%	0.395	C	S	.	.			trans	-80.8	109.8	177.2	-55.7	171	0	0	0	109.8	S42 W107 T219 K221 D227 F228	S42-I223 WeakPolarHBondContact OG-CD1 3.19Å; W107-I223 HydrophobicContact CH2-CD1 4.16Å; W107-I223 HydrophobicContact CH2-CG2 3.75Å; W107-I223 HydrophobicContact CZ3-CD1 4.13Å; W107-I223 HydrophobicContact CZ3-CG2 3.68Å; T219-I223 WeakPolarHBondContact CG2-O 3.4Å; K221-I223 VanDerWaalsContact C-N 3.31Å; K221-I223 PolarHBondContact O-N 3.31Å; I223-D227 HydrophobicContact CG2-CB 4Å; I223-F228 HydrophobicContact CG2-CB 4.45Å
224	E	45.2	Very low	47.1	Very low	100 Å²	100	69.4 Å²	69.4	47%	0.467	37%	0.366	S	S	.	.			trans	-61.1	149.5	178.1	-68.6	-169.2	179.3	0	0	111.2	G222 K226 D227 F228	G222-E224 PolarHBondContact O-N 3.37Å; E224-K226 HydrophobicContact CB-CD 4.48Å; E224-K226 HydrophobicContact CB-CG 4.04Å; E224-K226 PolarHBondContact O-N 3.19Å; E224-K226 VanDerWaalsContact O-N 3.15Å; E224-K226 VanDerWaalsContact OE2-CD 3.23Å; E224-K226 WeakPolarHBondContact OE2-CD 3.26Å; E224-K226 WeakPolarHBondContact OE2-CE 3.49Å; E224-K226 IonicContact OE2-NZ 2.65Å; E224-K226 PolarHBondContact OE2-NZ 3.03Å; E224-D227 PolarHBondContact O-N 3.33Å; E224-F228 PolarHBondContact O-N 2.98Å
225	L	52.7	Low	47.6	Very low	58 Å²	58	69.2 Å²	69.2	30%	0.304	37%	0.371	S	S	.	.	H	α-helix	trans	-54.7	-37.1	178.4	179.5	63.5	0	0	0	111	C215 D227 F228 L229	C215-L225 HydrophobicContact CB-CD1 4.05Å; C215-L225 HydrophobicContact CB-CD2 4.21Å; L225-D227 VanDerWaalsContact C-N 3.29Å; L225-D227 PolarHBondContact O-N 3.18Å; L225-F228 WeakPolarHBondContact O-CB 3.45Å; L225-F228 PolarHBondContact O-N 3.16Å; L225-L229 HydrophobicContact CD1-CD1 4.25Å; L225-L229 HydrophobicContact CD1-CD2 4.44Å; L225-L229 HydrophobicContact CD1-CG 4.06Å; L225-L229 HydrophobicContact CD2-CD1 4.39Å; L225-L229 HydrophobicContact CG-CD1 3.87Å; L225-L229 HydrophobicContact CG-CG 4.11Å; L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 WeakPolarHBondContact O-CG 3.33Å; L225-L229 PolarHBondContact O-N 3.16Å
226	K	56.9	Low	47.8	Very low	125 Å²	125	70.3 Å²	70.3	54%	0.543	39%	0.387	S	S	.	.	H	α-helix	trans	-59.5	-39.8	176.6	81.3	-171.6	-174.1	-154	0	112	E224 L229 A230	E224-K226 HydrophobicContact CB-CD 4.48Å; E224-K226 HydrophobicContact CB-CG 4.04Å; E224-K226 PolarHBondContact O-N 3.19Å; E224-K226 VanDerWaalsContact O-N 3.15Å; E224-K226 VanDerWaalsContact OE2-CD 3.23Å; E224-K226 WeakPolarHBondContact OE2-CD 3.26Å; E224-K226 WeakPolarHBondContact OE2-CE 3.49Å; E224-K226 IonicContact OE2-NZ 2.65Å; E224-K226 PolarHBondContact OE2-NZ 3.03Å; K226-L229 PolarHBondContact O-N 3.2Å; K226-A230 WeakPolarHBondContact O-CB 3.42Å; K226-A230 PolarHBondContact O-N 2.93Å
227	D	56.5	Low	47.5	Very low	67 Å²	67	73.4 Å²	73.4	36%	0.358	40%	0.401	S	S	.	.	H	α-helix	trans	-75.1	-37.7	-178.5	-58.1	-30.7	0	0	0	109.7	I223 E224 L225 L229 A230 E231	I223-D227 HydrophobicContact CG2-CB 4Å; E224-D227 PolarHBondContact O-N 3.33Å; L225-D227 VanDerWaalsContact C-N 3.29Å; L225-D227 PolarHBondContact O-N 3.18Å; D227-L229 VanDerWaalsContact C-N 3.34Å; D227-L229 PolarHBondContact O-N 3.25Å; D227-A230 PolarHBondContact O-N 3.03Å; D227-E231 VanDerWaalsContact O-CB 3.26Å; D227-E231 WeakPolarHBondContact O-CB 3.36Å; D227-E231 WeakPolarHBondContact O-CG 3Å; D227-E231 PolarHBondContact O-N 3.46Å
228	F	55.4	Low	47.1	Very low	2 Å²	2	69.6 Å²	69.6	1%	0.009	39%	0.39	C	S	.	.	H	α-helix	trans	-60.8	-42.6	171	-174.7	-81.6	0	0	0	112.6	C40 R95 W107 L108 I223 E224 L225 C232 Y234	C40-F228 HydrophobicContact CB-CD1 4.15Å; C40-F228 HydrophobicContact CB-CD2 3.51Å; C40-F228 HydrophobicContact CB-CE1 4.23Å; C40-F228 HydrophobicContact CB-CE2 3.63Å; C40-F228 HydrophobicContact CB-CG 3.82Å; C40-F228 HydrophobicContact CB-CZ 3.99Å; R95-F228 HydrophobicContact CB-CZ 4.35Å; R95-F228 HydrophobicContact CG-CE1 3.92Å; R95-F228 HydrophobicContact CG-CZ 3.71Å; W107-F228 HydrophobicContact CB-CE2 4.33Å; W107-F228 HydrophobicContact CD2-CD2 4.43Å; W107-F228 HydrophobicContact CE3-CB 4.36Å; W107-F228 AromaticContact CE3-CD2 3.2Å; W107-F228 HydrophobicContact CE3-CD2 3.2Å; W107-F228 AromaticContact CE3-CE2 3.59Å; W107-F228 HydrophobicContact CE3-CE2 3.59Å; W107-F228 AromaticContact CE3-CG 3.94Å; W107-F228 HydrophobicContact CE3-CG 3.94Å; W107-F228 HydrophobicContact CZ3-CB 3.88Å; W107-F228 AromaticContact CZ3-CD2 3.45Å; W107-F228 HydrophobicContact CZ3-CD2 3.45Å; W107-F228 VanDerWaalsContact CZ3-CD2 3.45Å; W107-F228 HydrophobicContact CZ3-CE2 4.29Å; W107-F228 AromaticContact CZ3-CG 3.97Å; W107-F228 HydrophobicContact CZ3-CG 3.97Å; L108-F228 WeakPolarHBondContact O-CE2 3.43Å; L108-F228 WeakPolarHBondContact O-CZ 3.41Å; I223-F228 HydrophobicContact CG2-CB 4.45Å; E224-F228 PolarHBondContact O-N 2.98Å; L225-F228 WeakPolarHBondContact O-CB 3.45Å; L225-F228 PolarHBondContact O-N 3.16Å; F228-C232 PolarHBondContact O-N 3.4Å; F228-Y234 HydrophobicContact CE1-CE2 4.17Å
229	L	57.7	Low	46.6	Very low	50 Å²	50	75.3 Å²	75.3	26%	0.262	41%	0.414	S	S	.	.	H	α-helix	trans	-73.3	-32.6	177.9	-68.3	178.5	0	0	0	112.4	L225 K226 D227 Y234	L225-L229 HydrophobicContact CD1-CD1 4.25Å; L225-L229 HydrophobicContact CD1-CD2 4.44Å; L225-L229 HydrophobicContact CD1-CG 4.06Å; L225-L229 HydrophobicContact CD2-CD1 4.39Å; L225-L229 HydrophobicContact CG-CD1 3.87Å; L225-L229 HydrophobicContact CG-CG 4.11Å; L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 WeakPolarHBondContact O-CG 3.33Å; L225-L229 PolarHBondContact O-N 3.16Å; K226-L229 PolarHBondContact O-N 3.2Å; D227-L229 VanDerWaalsContact C-N 3.34Å; D227-L229 PolarHBondContact O-N 3.25Å; L229-Y234 HydrophobicContact CD2-CD1 3.96Å; L229-Y234 HydrophobicContact CD2-CD2 3.1Å; L229-Y234 HydrophobicContact CD2-CE1 4.27Å; L229-Y234 HydrophobicContact CD2-CE2 3.45Å; L229-Y234 VanDerWaalsContact CD2-CE2 3.45Å; L229-Y234 HydrophobicContact CD2-CG 3.37Å
230	A	62.2	Low	46	Very low	82 Å²	82	78.4 Å²	78.4	68%	0.678	44%	0.435	S	S	*	.	H	α-helix	trans	-72.3	-35.4	176.4	0	0	0	0	0	111.5	K226 D227	K226-A230 WeakPolarHBondContact O-CB 3.42Å; K226-A230 PolarHBondContact O-N 2.93Å; D227-A230 PolarHBondContact O-N 3.03Å
231	E	66.2	Low	45.3	Very low	86 Å²	86	82.4 Å²	82.4	40%	0.402	46%	0.459	S	S	.	.	H	α-helix	trans	-74.1	-41.3	-177.9	-79.2	-77.3	174.8	0	0	112.3	R98 W107 D227	R98-E231 PolarHBondContact NE-O 3.3Å; R98-E231 IonicContact NE-OE2 2.98Å; R98-E231 PolarHBondContact NH2-O 3.35Å; W107-E231 HydrophobicContact CD2-CB 4.33Å; W107-E231 HydrophobicContact CH2-CB 3.91Å; W107-E231 HydrophobicContact CH2-CG 3.79Å; W107-E231 HydrophobicContact CZ2-CB 3.5Å; W107-E231 HydrophobicContact CZ2-CG 3.4Å; W107-E231 VanDerWaalsContact CZ2-CG 3.4Å; W107-E231 HydrophobicContact CZ3-CB 4.5Å; D227-E231 VanDerWaalsContact O-CB 3.26Å; D227-E231 WeakPolarHBondContact O-CB 3.36Å; D227-E231 WeakPolarHBondContact O-CG 3Å; D227-E231 PolarHBondContact O-N 3.46Å
232	C	66.9	Low	44.4	Very low	1 Å²	1	82.6 Å²	82.6	1%	0.007	47%	0.471	C	S	.	.	S	Bend	trans	-109.8	121.2	175.9	-60.2	0	0	0	0	110.7	R95 C96 W107 F228 Y234	R95-C232 HydrophobicContact CB-CB 4.07Å; C96-C232 HydrophobicContact CB-CB 3.77Å; C96-C232 WeakPolarHBondContact CB-SG 3.49Å; C96-C232 PolarHBondContact N-SG 2.99Å; C96-C232 VanDerWaalsContact N-SG 3.43Å; C96-C232 WeakPolarHBondContact SG-CA 3.15Å; C96-C232 WeakPolarHBondContact SG-CB 3.34Å; C96-C232 CovalentContact SG-SG 2.03Å; C96-C232 PolarHBondContact SG-SG 3.37Å; W107-C232 WeakPolarHBondContact CB-SG 3.2Å; W107-C232 VanDerWaalsContact CG-SG 3.58Å; F228-C232 PolarHBondContact O-N 3.4Å; C232-Y234 PolarHBondContact O-N 2.84Å
233	D	55.6	Low	43.7	Very low	131 Å²	131	87 Å²	87	70%	0.701	48%	0.481	S	S	*	.			trans	-55.6	105.5	175.1	-146.2	-6.3	0	0	0	109.4	E235	D233-E235 VanDerWaalsContact C-N 3.31Å; D233-E235 PolarHBondContact O-N 3.31Å
234	Y	45.9	Very low	42.7	Very low	36 Å²	36	92.1 Å²	92.1	14%	0.141	51%	0.507	C	S	.	.			trans	-87	77.5	-167	-152.1	-88.8	0	0	0	108.2	R95 F228 L229 C232 G236 I237	R95-Y234 VanDerWaalsContact NH2-CE2 3.26Å; R95-Y234 VanDerWaalsContact NH2-CG 3.31Å; F228-Y234 HydrophobicContact CE1-CE2 4.17Å; L229-Y234 HydrophobicContact CD2-CD1 3.96Å; L229-Y234 HydrophobicContact CD2-CD2 3.1Å; L229-Y234 HydrophobicContact CD2-CE1 4.27Å; L229-Y234 HydrophobicContact CD2-CE2 3.45Å; L229-Y234 VanDerWaalsContact CD2-CE2 3.45Å; L229-Y234 HydrophobicContact CD2-CG 3.37Å; C232-Y234 PolarHBondContact O-N 2.84Å; Y234-G236 VanDerWaalsContact C-N 3.27Å; Y234-G236 PolarHBondContact O-N 3.1Å; Y234-I237 HydrophobicContact CD1-CG1 4.18Å; Y234-I237 PolarHBondContact O-N 3.29Å
235	E	38.9	Very low	41.8	Very low	160 Å²	160	94.7 Å²	94.7	75%	0.748	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	97.9	161.4	-72.3	-166.7	158.2	0	0	107.5	D233	D233-E235 VanDerWaalsContact C-N 3.31Å; D233-E235 PolarHBondContact O-N 3.31Å
236	G	34	Very low	40.6	Very low	53 Å²	53	101.1 Å²	101.1	55%	0.546	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	149.6	-5.1	-172.6	0	0	0	0	0	116.9	Y234 P238	Y234-G236 VanDerWaalsContact C-N 3.27Å; Y234-G236 PolarHBondContact O-N 3.1Å; G236-P238 VanDerWaalsContact O-CD 3.22Å; G236-P238 WeakPolarHBondContact O-CD 3.27Å
237	I	28.5	Very low	39.2	Very low	114 Å²	114	104.4 Å²	104.4	59%	0.585	56%	0.564	S	S	*	*			trans	-75.2	111.2	158.9	-57.4	177.2	0	0	0	105.5	Y234 Q239	Y234-I237 HydrophobicContact CD1-CG1 4.18Å; Y234-I237 PolarHBondContact O-N 3.29Å; I237-Q239 PolarHBondContact O-N 3.3Å
238	P	27.6	Very low	38.1	Very low	83 Å²	83	106.5 Å²	106.5	54%	0.539	58%	0.579	S	S	.	*			trans	-61.7	115.8	160.2	-0.2	17.3	0	0	0	104.2	G236 V241	G236-P238 VanDerWaalsContact O-CD 3.22Å; G236-P238 WeakPolarHBondContact O-CD 3.27Å; P238-V241 HydrophobicContact CB-CG2 4.46Å
239	Q	24.8	Very low	36.9	Very low	166 Å²	166	110.7 Å²	110.7	78%	0.776	60%	0.602	S	S	*	*			trans	-46.9	142.8	154.9	-71.9	-160.8	-11.7	0	0	107.2	I237 V241	I237-Q239 PolarHBondContact O-N 3.3Å; Q239-V241 PolarHBondContact O-N 3.38Å
240	P	23.9	Very low	36	Very low	115 Å²	115	114.7 Å²	114.7	75%	0.747	62%	0.624	S	S	*	*			trans	-46.7	120.2	179	20.1	-32.4	0	0	0	107.8	T242	P240-T242 PolarHBondContact O-N 2.62Å
241	V	24.7	Very low	34.7	Very low	85 Å²	85	117.5 Å²	117.5	52%	0.515	62%	0.621	S	S	.	*			trans	-69.5	84.6	-177	176.9	0	0	0	0	106.8	P238 Q239 L244	P238-V241 HydrophobicContact CB-CG2 4.46Å; Q239-V241 PolarHBondContact O-N 3.38Å; V241-L244 HydrophobicContact CB-CD1 4.28Å; V241-L244 HydrophobicContact CG1-CB 3.44Å; V241-L244 VanDerWaalsContact CG1-CB 3.44Å; V241-L244 HydrophobicContact CG1-CD1 3.41Å; V241-L244 VanDerWaalsContact CG1-CD1 3.41Å; V241-L244 HydrophobicContact CG1-CG 3.54Å; V241-L244 HydrophobicContact CG2-CD1 3.89Å
242	T	25.3	Very low	33.2	Very low	128 Å²	128	116.9 Å²	116.9	79%	0.785	62%	0.623	S	S	*	*	S	Bend	trans	-87.3	112.4	147	38.3	0	0	0	0	105.3	P240	P240-T242 PolarHBondContact O-N 2.62Å
243	D	23.7	Very low	31.7	Very low	150 Å²	150	119.9 Å²	119.9	80%	0.802	64%	0.641	S	S	*	*			trans	82.9	64.1	179.9	-63.8	-28.4	0	0	0	119.4	N245	D243-N245 VanDerWaalsContact C-N 3.26Å; D243-N245 PolarHBondContact O-N 3.4Å
244	L	25	Very low	30.7	Very low	142 Å²	142	118.9 Å²	118.9	74%	0.743	63%	0.632	S	S	*	*			trans	-84.9	72.2	150.4	-103.2	159.6	0	0	0	109.8	V241	V241-L244 HydrophobicContact CB-CD1 4.28Å; V241-L244 HydrophobicContact CG1-CB 3.44Å; V241-L244 VanDerWaalsContact CG1-CB 3.44Å; V241-L244 HydrophobicContact CG1-CD1 3.41Å; V241-L244 VanDerWaalsContact CG1-CD1 3.41Å; V241-L244 HydrophobicContact CG1-CG 3.54Å; V241-L244 HydrophobicContact CG2-CD1 3.89Å
245	N	26.2	Very low	30.1	Very low	155 Å²	155	123.1 Å²	123.1	83%	0.829	65%	0.654	S	S	*	*			trans	-131.9	14.8	160.9	-109.4	-14.1	0	0	0	112.6	D243	D243-N245 VanDerWaalsContact C-N 3.26Å; D243-N245 PolarHBondContact O-N 3.4Å
246	K	26.7	Very low	29.7	Very low	192 Å²	192	120.8 Å²	120.8	84%	0.835	65%	0.646	S	S	*	*	S	Bend	trans	-106.8	105.7	173.9	-93.8	178.8	176.1	173.3	0	111.7	V248	K246-V248 PolarHBondContact O-N 3.44Å
247	K	27.5	Very low	29.7	Very low	194 Å²	194	123.2 Å²	123.2	84%	0.843	64%	0.644	S	S	*	*			trans	-7.8	117.2	157.7	-73.9	177.9	171.3	-175.5	0	113.7	D249	K247-D249 PolarHBondContact O-N 2.68Å; K247-D249 VanDerWaalsContact O-N 3.11Å
248	V	32.5	Very low	29.8	Very low	111 Å²	111	124.9 Å²	124.9	67%	0.673	65%	0.646	S	S	*	*			trans	-52.3	115.2	147	176.8	0	0	0	0	105.8	K246 D250 V253	K246-V248 PolarHBondContact O-N 3.44Å; V248-D250 PolarHBondContact O-N 3.02Å; V248-V253 HydrophobicContact CG1-CG2 3.75Å
249	D	32	Very low	30	Very low	91 Å²	91	124.4 Å²	124.4	49%	0.487	65%	0.65	S	S	.	*			trans	-59.1	120.7	176	167.5	12.3	0	0	0	108.7	K247 K251 T252	K247-D249 PolarHBondContact O-N 2.68Å; K247-D249 VanDerWaalsContact O-N 3.11Å; D249-K251 PolarHBondContact O-N 2.93Å; D249-K251 WeakPolarHBondContact OD1-CB 2.9Å; D249-K251 PolarHBondContact OD1-N 3.15Å; D249-K251 WeakPolarHBondContact OD2-CB 3.37Å; D249-T252 PolarHBondContact O-N 3.42Å
250	D	37.2	Very low	30.3	Very low	134 Å²	134	120.4 Å²	120.4	72%	0.717	63%	0.633	S	S	*	*	H	α-helix	trans	-48.3	-25.1	176.5	-71.7	-37.3	0	0	0	112.5	V248 T252 H254	V248-D250 PolarHBondContact O-N 3.02Å; D250-T252 PolarHBondContact O-N 3.32Å; D250-H254 WeakPolarHBondContact O-CB 3.43Å; D250-H254 PolarHBondContact O-N 3.1Å
251	K	35.6	Very low	30.4	Very low	141 Å²	141	120.7 Å²	120.7	61%	0.613	63%	0.628	S	S	*	*	H	α-helix	trans	-69.1	-28.5	176.8	-145.5	177.5	-168.5	-179.5	0	113.8	D249 M255	D249-K251 PolarHBondContact O-N 2.93Å; D249-K251 WeakPolarHBondContact OD1-CB 2.9Å; D249-K251 PolarHBondContact OD1-N 3.15Å; D249-K251 WeakPolarHBondContact OD2-CB 3.37Å; K251-M255 PolarHBondContact O-N 3.21Å; K251-M255 VanDerWaalsContact O-N 3.11Å
252	T	35.8	Very low	30.5	Very low	73 Å²	73	123.5 Å²	123.5	45%	0.448	63%	0.634	S	S	.	*	H	α-helix	trans	-79.3	-37.4	178.3	-54.3	0	0	0	0	111.1	D249 D250 L256	D249-T252 PolarHBondContact O-N 3.42Å; D250-T252 PolarHBondContact O-N 3.32Å; T252-L256 PolarHBondContact O-N 3.22Å
253	V	35.1	Very low	30.3	Very low	63 Å²	63	124 Å²	124	38%	0.382	63%	0.631	S	S	.	*	H	α-helix	trans	-65.7	-42.4	171.8	179.3	0	0	0	0	110	V248 M255 L256 E257	V248-V253 HydrophobicContact CG1-CG2 3.75Å; V253-M255 PolarHBondContact O-N 3.47Å; V253-L256 PolarHBondContact O-N 3.37Å; V253-E257 HydrophobicContact CG1-CG 4.5Å; V253-E257 WeakPolarHBondContact O-CG 2.99Å; V253-E257 PolarHBondContact O-N 2.8Å
254	H	35	Very low	30.6	Very low	110 Å²	110	126.2 Å²	126.2	51%	0.509	65%	0.65	S	S	.	*	H	α-helix	trans	-68	-31.7	179.1	-162.5	34.7	0	0	0	113.8	D250 E257 K258	D250-H254 WeakPolarHBondContact O-CB 3.43Å; D250-H254 PolarHBondContact O-N 3.1Å; H254-E257 IonicContact ND1-OE2 3.02Å; H254-K258 WeakPolarHBondContact O-CB 3.23Å; H254-K258 PolarHBondContact O-N 2.82Å
255	M	33	Very low	30.8	Very low	126 Å²	126	125.5 Å²	125.5	62%	0.621	65%	0.645	S	S	*	*	H	α-helix	trans	-70.4	-34.3	172.1	-82.5	-167.2	-91.4	0	0	112.9	K251 V253 A259	K251-M255 PolarHBondContact O-N 3.21Å; K251-M255 VanDerWaalsContact O-N 3.11Å; V253-M255 PolarHBondContact O-N 3.47Å; M255-A259 PolarHBondContact O-N 3.11Å
256	L	30.2	Very low	31.1	Very low	110 Å²	110	123.9 Å²	123.9	58%	0.576	64%	0.636	S	S	*	*	H	α-helix	trans	-71.4	-39.7	173.9	-85	156.2	0	0	0	111.9	T252 V253 A259 I260	T252-L256 PolarHBondContact O-N 3.22Å; V253-L256 PolarHBondContact O-N 3.37Å; L256-A259 PolarHBondContact O-N 2.65Å; L256-I260 WeakPolarHBondContact O-CD1 3.23Å; L256-I260 VanDerWaalsContact O-CG1 3.28Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 PolarHBondContact O-N 2.76Å
257	E	32.6	Very low	31.3	Very low	105 Å²	105	120.1 Å²	120.1	49%	0.491	63%	0.625	S	S	.	*	H	α-helix	trans	-65	-37.1	173.7	-75.1	177.8	158.7	0	0	112.5	V253 H254 A259 I260 N261	V253-E257 HydrophobicContact CG1-CG 4.5Å; V253-E257 WeakPolarHBondContact O-CG 2.99Å; V253-E257 PolarHBondContact O-N 2.8Å; H254-E257 IonicContact ND1-OE2 3.02Å; E257-A259 VanDerWaalsContact C-N 3.33Å; E257-A259 PolarHBondContact O-N 2.9Å; E257-I260 PolarHBondContact O-N 3.48Å; E257-N261 WeakPolarHBondContact O-CB 3.14Å; E257-N261 PolarHBondContact O-N 3.27Å
258	K	32.6	Very low	31.5	Very low	148 Å²	148	115.8 Å²	115.8	64%	0.643	61%	0.612	S	S	*	*	H	α-helix	trans	-68.3	-28.5	173.5	-109.6	-177.2	175.8	179	0	113.9	H254 I260	H254-K258 WeakPolarHBondContact O-CB 3.23Å; H254-K258 PolarHBondContact O-N 2.82Å; K258-I260 VanDerWaalsContact C-N 3.33Å
259	A	30.6	Very low	31.5	Very low	74 Å²	74	116.1 Å²	116.1	61%	0.612	61%	0.608	S	S	*	*	H	α-helix	trans	-77.8	-22	175.6	0	0	0	0	0	112.4	M255 L256 E257	M255-A259 PolarHBondContact O-N 3.11Å; L256-A259 PolarHBondContact O-N 2.65Å; E257-A259 VanDerWaalsContact C-N 3.33Å; E257-A259 PolarHBondContact O-N 2.9Å
260	I	32.1	Very low	31.4	Very low	81 Å²	81	117.7 Å²	117.7	42%	0.415	62%	0.616	S	S	.	*	H	α-helix	trans	-91.2	-31.5	179.4	-65.9	166.6	0	0	0	111.3	L256 E257 K258 F262	L256-I260 WeakPolarHBondContact O-CD1 3.23Å; L256-I260 VanDerWaalsContact O-CG1 3.28Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 PolarHBondContact O-N 2.76Å; E257-I260 PolarHBondContact O-N 3.48Å; K258-I260 VanDerWaalsContact C-N 3.33Å; I260-F262 PolarHBondContact O-N 2.92Å
261	N	25.5	Very low	31	Very low	121 Å²	121	116.6 Å²	116.6	65%	0.647	61%	0.609	S	S	*	*			trans	-98.3	62	179.2	-72.9	-16.9	0	0	0	113.6	E257 D263	E257-N261 WeakPolarHBondContact O-CB 3.14Å; E257-N261 PolarHBondContact O-N 3.27Å; N261-D263 PolarHBondContact O-N 2.75Å
262	F	25.7	Very low	30.7	Very low	145 Å²	145	114.7 Å²	114.7	64%	0.636	61%	0.609	S	S	*	*			trans	-84.3	63	162	-109.4	-83.1	0	0	0	110.5	F193 I260 V264	F193-F262 WeakPolarHBondContact CE1-O 3.18Å; F193-F262 HydrophobicContact CE2-CB 4.13Å; F193-F262 HydrophobicContact CZ-CB 4.16Å; F193-F262 WeakPolarHBondContact CZ-O 3.26Å; I260-F262 PolarHBondContact O-N 2.92Å; F262-V264 PolarHBondContact O-N 3.21Å
263	D	21.8	Very low	30.3	Very low	138 Å²	138	118.2 Å²	118.2	74%	0.738	62%	0.622	S	S	*	*			trans	-71.1	114.4	162.8	-95.8	-28	0	0	0	109.1	N261	N261-D263 PolarHBondContact O-N 2.75Å
264	V	29.1	Very low	29.8	Very low	197 Å²	197	123.2 Å²	123.2	100%	1.194	64%	0.644	S	S	*	*			trans	-127.6	0	144.1	-179.2	0	0	0	0	107	F262	F262-V264 PolarHBondContact O-N 3.21Å

Retrieved 264 of 264 residues in 232.6 ms (Link to these results)

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