A0A087YB65_POEFO Loading...

TGFB-induced factor homeobox 1

AlphaFold DB , UniProt , Accession A0A087YB65, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 300 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	45.1	Very low	50	Low	230 Å²	230	157.7 Å²	157.7	100%	1.133	85%	0.845	S	S	*	*				0	112.7	0	34.7	171.8	70.6	0	0	109.2
2	K	38.8	Very low	49.2	Very low	212 Å²	212	150.3 Å²	150.3	92%	0.922	83%	0.833	S	S	*	*			trans	165.2	91.3	150.5	-88.8	135.9	75.9	-177.8	0	107.9
3	T	52.7	Low	48.9	Very low	132 Å²	132	147.1 Å²	147.1	81%	0.81	83%	0.827	S	S	*	*			trans	-74.7	167.1	167	54.8	0	0	0	0	108.5
4	K	56.9	Low	48.6	Very low	171 Å²	171	150.3 Å²	150.3	74%	0.743	83%	0.832	S	S	*	*			cis	-174.1	130.2	30.7	-164.5	162.8	166.8	175.4	0	108.3
5	K	55.8	Low	49.2	Very low	187 Å²	187	148.9 Å²	148.9	81%	0.813	83%	0.83	S	S	*	*			trans	41.7	128.5	134.6	-51.6	176.7	-179	-177.1	0	120.9
6	G	50.4	Low	49.1	Very low	76 Å²	76	148.8 Å²	148.8	78%	0.784	83%	0.827	S	S	*	*			trans	-87.8	178.4	153.4	0	0	0	0	0	113.3
7	L	45.5	Very low	49.5	Very low	167 Å²	167	149 Å²	149	87%	0.874	83%	0.826	S	S	*	*			trans	165.4	142.8	137.1	-172.6	60.3	0	0	0	109
8	T	52.9	Low	50	Low	111 Å²	111	150.7 Å²	150.7	68%	0.681	83%	0.827	S	S	*	*			trans	-78.2	-174	-178.8	47.8	0	0	0	0	113.9
9	M	48.1	Very low	49.9	Very low	160 Å²	160	150.4 Å²	150.4	79%	0.788	83%	0.825	S	S	*	*			trans	96.2	136.1	175.6	-45.3	-64.1	-93.9	0	0	112
10	L	51.6	Low	50.3	Low	158 Å²	158	148.4 Å²	148.4	83%	0.827	82%	0.822	S	S	*	*			cis	-165.3	134.9	40.5	-42.2	150.6	0	0	0	105.9
11	S	51.7	Low	50.9	Low	131 Å²	131	147.3 Å²	147.3	92%	0.916	82%	0.819	S	S	*	*				56.2	127.1	78.1	-157.8	0	0	0	0	118.9
12	G	40.5	Very low	51.2	Low	68 Å²	68	144 Å²	144	70%	0.701	81%	0.805	S	S	*	*			trans	104.4	146.7	158	0	0	0	0	0	116
13	S	45.9	Very low	52.1	Low	109 Å²	109	138.1 Å²	138.1	76%	0.762	80%	0.797	S	S	*	*			cis	-171.6	129.3	-5.3	-80.7	0	0	0	0	105.6
14	E	44	Very low	52	Low	192 Å²	192	137.7 Å²	137.7	90%	0.897	80%	0.796	S	S	*	*				23.7	109.6	110.4	-64.2	-177.9	113.1	0	0	116.5
15	T	57.6	Low	51.9	Low	130 Å²	130	137.2 Å²	137.2	80%	0.798	80%	0.801	S	S	*	*			trans	-147	119.7	148.9	52.1	0	0	0	0	110.1
16	D	47.5	Very low	51.3	Low	147 Å²	147	134.4 Å²	134.4	79%	0.786	80%	0.795	S	S	*	*			trans	-79.5	128.9	167.5	-142.2	-92	0	0	0	107.5
17	D	56.4	Low	51.4	Low	152 Å²	152	138.2 Å²	138.2	81%	0.813	80%	0.796	S	S	*	*			trans	-147.7	95.5	167.9	-79.8	-63	0	0	0	109.5
18	E	57.7	Low	51.7	Low	179 Å²	179	134.7 Å²	134.7	84%	0.836	79%	0.786	S	S	*	*			trans	-82.2	119	163.1	-66.8	-95.5	108.3	0	0	109.1
19	D	49.8	Very low	51.4	Low	146 Å²	146	134.1 Å²	134.1	78%	0.781	79%	0.786	S	S	*	*			trans	167	113.1	142	-170	-94.5	0	0	0	109.7
20	S	56.4	Low	51.4	Low	110 Å²	110	132.4 Å²	132.4	77%	0.769	79%	0.79	S	S	*	*				179.6	135.8	124.3	-141.5	0	0	0	0	112
21	V	63	Low	51.3	Low	125 Å²	125	128.3 Å²	128.3	76%	0.758	78%	0.779	S	S	*	*			trans	-73	156.3	-170.7	-66.2	0	0	0	0	114.8
22	D	52	Low	51.2	Low	160 Å²	160	124.8 Å²	124.8	86%	0.856	76%	0.763	S	S	*	*			trans	74.4	94.7	149.2	-146	-97.5	0	0	0	118.8
23	A	57.5	Low	51.7	Low	89 Å²	89	127 Å²	127	74%	0.736	77%	0.768	S	S	*	*			trans	-157	140	146.9	0	0	0	0	0	110.9
24	P	50.6	Low	52	Low	123 Å²	123	128.9 Å²	128.9	80%	0.799	77%	0.77	S	S	*	*			trans	-76.6	144.3	-142.6	27.9	-35.6	0	0	0	115.3	D26	P24-D26 VanDerWaalsContact C-N 3.31Å; P24-D26 PolarHBondContact O-N 2.88Å
25	L	54.5	Low	52.5	Low	162 Å²	162	122.4 Å²	122.4	85%	0.848	75%	0.754	S	S	*	*			trans	-64.6	84.3	166.5	-56	174	0	0	0	110.2	L27	L25-L27 PolarHBondContact O-N 3.45Å
26	D	42.9	Very low	52.6	Low	127 Å²	127	125 Å²	125	68%	0.679	75%	0.754	S	S	*	*			trans	-78.5	76.3	164.7	-170.8	19.8	0	0	0	110	P24 S28	P24-D26 VanDerWaalsContact C-N 3.31Å; P24-D26 PolarHBondContact O-N 2.88Å; D26-S28 PolarHBondContact O-N 3.49Å; D26-S28 VanDerWaalsContact O-N 3.08Å; D26-S28 PolarHBondContact OD1-N 2.94Å
27	L	52.8	Low	53.2	Low	156 Å²	156	129.1 Å²	129.1	82%	0.817	76%	0.759	S	S	*	*			trans	-77.4	59.6	161.2	-65.1	175.2	0	0	0	109.5	L25	L25-L27 PolarHBondContact O-N 3.45Å
28	S	51.8	Low	53.6	Low	93 Å²	93	131.2 Å²	131.2	65%	0.65	76%	0.761	S	S	*	*			trans	-158	69.6	166.5	-98.7	0	0	0	0	113.3	D26	D26-S28 PolarHBondContact O-N 3.49Å; D26-S28 VanDerWaalsContact O-N 3.08Å; D26-S28 PolarHBondContact OD1-N 2.94Å
29	S	47	Very low	54	Low	99 Å²	99	134.2 Å²	134.2	69%	0.692	76%	0.764	S	S	*	*			trans	-147.9	69.5	141.6	-115.2	0	0	0	0	111.8	A31	S29-A31 PolarHBondContact O-N 2.88Å
30	S	48.5	Very low	55.4	Low	125 Å²	125	137.3 Å²	137.3	87%	0.874	77%	0.765	S	S	*	*				-61.8	67.1	126.5	-172.3	0	0	0	0	107.4	G32	S30-G32 PolarHBondContact O-N 3.2Å
31	A	49.9	Very low	56.7	Low	72 Å²	72	135.4 Å²	135.4	60%	0.595	76%	0.762	S	S	*	*			trans	-66	87.2	157.5	0	0	0	0	0	102.7	S29 S33	S29-A31 PolarHBondContact O-N 2.88Å; A31-S33 PolarHBondContact O-N 3Å
32	G	48	Very low	58.1	Low	56 Å²	56	137.4 Å²	137.4	58%	0.577	77%	0.769	S	S	*	*			trans	-39.7	112.5	167.5	0	0	0	0	0	104.8	S30 N34	S30-G32 PolarHBondContact O-N 3.2Å; G32-N34 PolarHBondContact O-N 3.28Å
33	S	51.2	Low	60.1	Low	115 Å²	115	132.1 Å²	132.1	80%	0.804	74%	0.74	S	S	*	*			trans	-58.8	92.4	169.8	57.5	0	0	0	0	102.6	A31 G35	A31-S33 PolarHBondContact O-N 3Å; S33-G35 PolarHBondContact O-N 2.77Å
34	N	52.8	Low	62	Low	149 Å²	149	131.4 Å²	131.4	80%	0.797	73%	0.728	S	S	*	*			trans	-72.6	74.8	175.6	-155.4	4.3	0	0	0	101.4	G32 K36	G32-N34 PolarHBondContact O-N 3.28Å; N34-K36 PolarHBondContact O-N 3.45Å
35	G	55.6	Low	64.2	Low	55 Å²	55	134.5 Å²	134.5	57%	0.567	73%	0.729	S	S	*	*			trans	-69.4	81.1	-177.5	0	0	0	0	0	103	S33 R37	S33-G35 PolarHBondContact O-N 2.77Å; G35-R37 WeakPolarHBondContact O-CA 3.46Å; G35-R37 PolarHBondContact O-N 3.14Å
36	K	58.3	Low	66.2	Low	185 Å²	185	133.9 Å²	133.9	80%	0.804	72%	0.722	S	S	*	*			trans	-36.9	100	151.8	-72.7	153.7	175.9	170.4	0	102.9	N34 K38	N34-K36 PolarHBondContact O-N 3.45Å; K36-K38 PolarHBondContact O-N 2.99Å
37	R	59.7	Low	68.8	Low	234 Å²	234	128.3 Å²	128.3	88%	0.883	69%	0.693	S	S	*	*			trans	-56.1	96.6	-175	-91.1	-178.2	-77.1	127.9	-3	103.8	G35 R39	G35-R37 WeakPolarHBondContact O-CA 3.46Å; G35-R37 PolarHBondContact O-N 3.14Å; R37-R39 PolarHBondContact O-N 2.88Å
38	K	64.9	Low	71	Confident	196 Å²	196	122 Å²	122	85%	0.852	66%	0.66	S	S	*	*			trans	-54.5	114.5	177.7	-83	175.7	174	175.6	0	102.2	K36 R40	K36-K38 PolarHBondContact O-N 2.99Å; K38-R40 PolarHBondContact O-N 3.24Å
39	R	67.8	Low	73.2	Confident	242 Å²	242	121.8 Å²	121.8	91%	0.913	65%	0.649	S	S	*	*			trans	-45	123.4	-180	-86.4	-174.5	158.8	-135.1	-0.6	105.9	R37 G41	R37-R39 PolarHBondContact O-N 2.88Å; R39-G41 PolarHBondContact O-N 3.49Å
40	R	77.6	Confident	75.7	Confident	211 Å²	211	119.2 Å²	119.2	80%	0.796	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-52.8	116.8	-178.3	-77.9	-174.7	176.9	-138.5	0.3	106.6	K38	K38-R40 PolarHBondContact O-N 3.24Å
41	G	84	Confident	78	Confident	69 Å²	69	113.3 Å²	113.3	71%	0.711	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-58.1	152.5	174.8	0	0	0	0	0	109.5	R39	R39-G41 PolarHBondContact O-N 3.49Å
42	N	92.6	Very high	80.3	Confident	167 Å²	167	115.1 Å²	115.1	89%	0.893	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-61.7	151	169.7	-67.3	-40.6	0	0	0	109.6
43	L	94.7	Very high	82.7	Confident	49 Å²	49	116.4 Å²	116.4	26%	0.257	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-68.8	149.6	174.9	-65.1	156.7	0	0	0	109.9	V48 L78 W86	L43-V48 HydrophobicContact CB-CG2 3.66Å; L43-V48 HydrophobicContact CD1-CG2 4.46Å; L43-L78 HydrophobicContact CD2-CD1 3.63Å; L43-L78 HydrophobicContact CD2-CD2 3.42Å; L43-L78 VanDerWaalsContact CD2-CD2 3.42Å; L43-L78 HydrophobicContact CD2-CG 4.14Å; L43-W86 HydrophobicContact CD1-CB 4.46Å; L43-W86 HydrophobicContact CD1-CG 4.2Å
44	P	96.1	Very high	85	Confident	74 Å²	74	112.2 Å²	112.2	48%	0.481	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-55.1	144.4	175.1	-22.6	32.5	0	0	0	111.8	E46 S47 V48	P44-E46 PolarHBondContact O-N 3.12Å; P44-S47 WeakPolarHBondContact O-CB 3.45Å; P44-S47 PolarHBondContact O-N 3.09Å; P44-V48 WeakPolarHBondContact O-CG2 3.36Å; P44-V48 PolarHBondContact O-N 3.33Å
45	K	96.7	Very high	87.1	Confident	188 Å²	188	105.1 Å²	105.1	82%	0.817	50%	0.5	S	S	*	.	H	α-helix	trans	-62.1	-43.4	-176.4	-67.5	-178.4	-179.7	-179.9	0	112.1	V48 Q49	K45-V48 PolarHBondContact O-N 3.28Å; K45-Q49 PolarHBondContact O-N 2.8Å
46	E	97.7	Very high	89	Confident	150 Å²	150	108.9 Å²	108.9	70%	0.701	50%	0.498	S	S	*	.	H	α-helix	trans	-55	-51.6	174.1	-66.6	-62.2	135.7	0	0	111.3	P44 V48 Q49 I50	P44-E46 PolarHBondContact O-N 3.12Å; E46-V48 VanDerWaalsContact C-N 3.31Å; E46-V48 PolarHBondContact O-N 2.65Å; E46-Q49 WeakPolarHBondContact O-CB 3.4Å; E46-Q49 PolarHBondContact O-N 2.87Å; E46-Q49 VanDerWaalsContact O-N 3.09Å; E46-I50 PolarHBondContact O-N 2.83Å; E46-I50 VanDerWaalsContact O-N 3.14Å
47	S	97.9	Very high	90.9	Very high	10 Å²	10	107 Å²	107	7%	0.07	49%	0.492	C	S	.	.	H	α-helix	trans	-56.8	-44.2	176.6	-53.6	0	0	0	0	111.8	P44 Q49 L51 T76	P44-S47 WeakPolarHBondContact O-CB 3.45Å; P44-S47 PolarHBondContact O-N 3.09Å; S47-Q49 VanDerWaalsContact C-N 3.32Å; S47-Q49 PolarHBondContact O-N 3.45Å; S47-L51 VanDerWaalsContact O-CG 3.29Å; S47-L51 WeakPolarHBondContact O-CG 3.48Å; S47-L51 PolarHBondContact O-N 3.41Å; S47-T76 WeakPolarHBondContact O-CG2 3.46Å; S47-T76 PolarHBondContact OG-O 2.95Å
48	V	98.1	Very high	92.6	Very high	22 Å²	22	98.4 Å²	98.4	13%	0.133	46%	0.462	C	S	.	.	H	α-helix	trans	-67.4	-33.6	178.5	173.6	0	0	0	0	111.9	L43 P44 K45 E46 L51 R52 W86	L43-V48 HydrophobicContact CB-CG2 3.66Å; L43-V48 HydrophobicContact CD1-CG2 4.46Å; P44-V48 WeakPolarHBondContact O-CG2 3.36Å; P44-V48 PolarHBondContact O-N 3.33Å; K45-V48 PolarHBondContact O-N 3.28Å; E46-V48 VanDerWaalsContact C-N 3.31Å; E46-V48 PolarHBondContact O-N 2.65Å; V48-L51 PolarHBondContact O-N 3.38Å; V48-R52 HydrophobicContact CG1-CG 4.31Å; V48-R52 WeakPolarHBondContact O-CB 3.29Å; V48-R52 VanDerWaalsContact O-CG 3.31Å; V48-R52 WeakPolarHBondContact O-CG 3.44Å; V48-R52 PolarHBondContact O-N 3.1Å; V48-W86 HydrophobicContact CG1-CZ2 4.13Å
49	Q	98.3	Very high	94	Very high	89 Å²	89	90.4 Å²	90.4	42%	0.416	43%	0.426	S	S	.	.	H	α-helix	trans	-64	-50.6	178.3	-172.6	58.2	42.4	0	0	110.7	K45 E46 S47 L51 R52 D53	K45-Q49 PolarHBondContact O-N 2.8Å; E46-Q49 WeakPolarHBondContact O-CB 3.4Å; E46-Q49 PolarHBondContact O-N 2.87Å; E46-Q49 VanDerWaalsContact O-N 3.09Å; S47-Q49 VanDerWaalsContact C-N 3.32Å; S47-Q49 PolarHBondContact O-N 3.45Å; Q49-L51 VanDerWaalsContact C-N 3.27Å; Q49-L51 PolarHBondContact O-N 3.35Å; Q49-R52 WeakPolarHBondContact O-CA 3.43Å; Q49-R52 WeakPolarHBondContact O-CB 3.49Å; Q49-R52 PolarHBondContact O-N 2.84Å; Q49-D53 PolarHBondContact NE2-OD1 3.23Å; Q49-D53 PolarHBondContact NE2-OD2 2.94Å; Q49-D53 VanDerWaalsContact O-CG 3.24Å; Q49-D53 PolarHBondContact O-N 3.34Å
50	I	98.3	Very high	95.2	Very high	46 Å²	46	83.6 Å²	83.6	24%	0.236	40%	0.401	C	S	.	.	H	α-helix	trans	-53.9	-44.9	176.2	-64.1	165.1	0	0	0	111.2	E46 R52 D53 W54 L72 Q75 T76	E46-I50 PolarHBondContact O-N 2.83Å; E46-I50 VanDerWaalsContact O-N 3.14Å; I50-R52 PolarHBondContact O-N 2.89Å; I50-D53 PolarHBondContact O-N 3.18Å; I50-W54 PolarHBondContact O-N 3.43Å; I50-W54 VanDerWaalsContact O-N 3.12Å; I50-L72 HydrophobicContact CG2-CD2 4.1Å; I50-Q75 HydrophobicContact CD1-CB 4.4Å; I50-Q75 HydrophobicContact CG2-CB 4.26Å; I50-T76 HydrophobicContact CB-CG2 3.96Å; I50-T76 HydrophobicContact CD1-CG2 4.27Å; I50-T76 HydrophobicContact CG2-CG2 3.89Å
51	L	98.4	Very high	95.9	Very high	0 Å²	0	78.5 Å²	78.5	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-67.9	-34.1	179.2	-62.6	171.7	0	0	0	112.8	S47 V48 Q49 L55 L72 T76 L78 V83 W86 F87	S47-L51 VanDerWaalsContact O-CG 3.29Å; S47-L51 WeakPolarHBondContact O-CG 3.48Å; S47-L51 PolarHBondContact O-N 3.41Å; V48-L51 PolarHBondContact O-N 3.38Å; Q49-L51 VanDerWaalsContact C-N 3.27Å; Q49-L51 PolarHBondContact O-N 3.35Å; L51-L55 WeakPolarHBondContact O-CB 3.42Å; L51-L55 PolarHBondContact O-N 3.21Å; L51-L72 HydrophobicContact CD2-CB 4.1Å; L51-L72 HydrophobicContact CD2-CD1 4.31Å; L51-L72 HydrophobicContact CD2-CD2 4.33Å; L51-L72 HydrophobicContact CD2-CG 4.49Å; L51-T76 HydrophobicContact CD1-CG2 4.49Å; L51-T76 HydrophobicContact CD2-CG2 3.99Å; L51-T76 HydrophobicContact CG-CG2 3.9Å; L51-L78 HydrophobicContact CD1-CD1 4.12Å; L51-V83 HydrophobicContact CD2-CG1 4.08Å; L51-W86 HydrophobicContact CB-CD2 4.01Å; L51-W86 HydrophobicContact CB-CE3 3.68Å; L51-W86 HydrophobicContact CB-CH2 3.53Å; L51-W86 HydrophobicContact CB-CZ2 3.84Å; L51-W86 HydrophobicContact CB-CZ3 3.45Å; L51-W86 VanDerWaalsContact CB-CZ3 3.45Å; L51-W86 HydrophobicContact CD1-CB 4.28Å; L51-W86 HydrophobicContact CD1-CD2 3.61Å; L51-W86 HydrophobicContact CD1-CE3 3.93Å; L51-W86 HydrophobicContact CD1-CG 3.77Å; L51-W86 HydrophobicContact CG-CD2 4.4Å; L51-W86 HydrophobicContact CG-CE3 4.29Å; L51-F87 HydrophobicContact CD2-CE2 3.79Å; L51-F87 HydrophobicContact CD2-CZ 4.22Å
52	R	97.8	Very high	96.4	Very high	110 Å²	110	75.4 Å²	75.4	42%	0.415	36%	0.357	S	S	.	.	H	α-helix	trans	-70.3	-39.4	175.6	-79.2	178.7	176.9	168.7	-0.5	112	V48 Q49 I50 L55 Y56 W86 L94	V48-R52 HydrophobicContact CG1-CG 4.31Å; V48-R52 WeakPolarHBondContact O-CB 3.29Å; V48-R52 VanDerWaalsContact O-CG 3.31Å; V48-R52 WeakPolarHBondContact O-CG 3.44Å; V48-R52 PolarHBondContact O-N 3.1Å; Q49-R52 WeakPolarHBondContact O-CA 3.43Å; Q49-R52 WeakPolarHBondContact O-CB 3.49Å; Q49-R52 PolarHBondContact O-N 2.84Å; I50-R52 PolarHBondContact O-N 2.89Å; R52-L55 PolarHBondContact O-N 3.48Å; R52-Y56 WeakPolarHBondContact O-CB 3.49Å; R52-Y56 PolarHBondContact O-N 3.45Å; R52-W86 HydrophobicContact CG-CH2 3.9Å; R52-W86 HydrophobicContact CG-CZ2 3.9Å; R52-L94 HydrophobicContact CG-CD1 4.39Å
53	D	98.2	Very high	96.6	Very high	84 Å²	84	72.9 Å²	72.9	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-63.1	-49.1	178.6	-64.4	-22.6	0	0	0	109.8	Q49 I50 L55 Y56 E57	Q49-D53 PolarHBondContact NE2-OD1 3.23Å; Q49-D53 PolarHBondContact NE2-OD2 2.94Å; Q49-D53 VanDerWaalsContact O-CG 3.24Å; Q49-D53 PolarHBondContact O-N 3.34Å; I50-D53 PolarHBondContact O-N 3.18Å; D53-L55 VanDerWaalsContact C-N 3.32Å; D53-L55 PolarHBondContact O-N 2.91Å; D53-Y56 PolarHBondContact O-N 2.86Å; D53-Y56 VanDerWaalsContact O-N 3.16Å; D53-E57 PolarHBondContact O-N 3.02Å
54	W	98.4	Very high	96.7	Very high	27 Å²	27	71 Å²	71	10%	0.102	33%	0.327	C	S	.	.	H	α-helix	trans	-58.4	-43.8	174	-171.3	93.6	0	0	0	111.8	I50 Y56 E57 H58 P64 E68 L72 F87	I50-W54 PolarHBondContact O-N 3.43Å; I50-W54 VanDerWaalsContact O-N 3.12Å; W54-Y56 VanDerWaalsContact C-N 3.3Å; W54-Y56 PolarHBondContact O-N 2.99Å; W54-E57 PolarHBondContact O-N 3.37Å; W54-H58 AromaticContact CD1-CE1 3.78Å; W54-H58 AromaticContact CD1-ND1 3.76Å; W54-H58 HydrophobicContact CD2-CB 4.34Å; W54-H58 AromaticContact CD2-ND1 3.64Å; W54-H58 AromaticContact CE2-CE1 3.76Å; W54-H58 AromaticContact CE2-CG 3.63Å; W54-H58 AromaticContact CE2-ND1 3.42Å; W54-H58 HydrophobicContact CE3-CB 4.08Å; W54-H58 AromaticContact CG-ND1 3.86Å; W54-H58 HydrophobicContact CH2-CB 3.61Å; W54-H58 AromaticContact CH2-CG 3.79Å; W54-H58 HydrophobicContact CZ2-CB 3.89Å; W54-H58 AromaticContact CZ2-CD2 3.71Å; W54-H58 AromaticContact CZ2-CG 3.51Å; W54-H58 AromaticContact CZ2-ND1 3.83Å; W54-H58 HydrophobicContact CZ3-CB 3.73Å; W54-H58 AromaticContact NE1-CE1 3.42Å; W54-H58 PolarHBondContact NE1-CE1 3.4Å; W54-H58 AromaticContact NE1-ND1 3.51Å; W54-H58 AromaticContact NE1-NE2 3.92Å; W54-H58 WeakPolarHBondContact O-CB 3.22Å; W54-H58 PolarHBondContact O-N 3.4Å; W54-H58 PolarHBondContact O-ND1 3.16Å; W54-P64 VanDerWaalsContact CH2-CA 3.45Å; W54-P64 HydrophobicContact CH2-CB 3.5Å; W54-P64 VanDerWaalsContact CH2-CB 3.5Å; W54-P64 HydrophobicContact CH2-CG 4.04Å; W54-P64 HydrophobicContact CZ2-CB 3.63Å; W54-P64 HydrophobicContact CZ3-CB 4.02Å; W54-P64 HydrophobicContact CZ3-CG 4.13Å; W54-E68 HydrophobicContact CZ2-CB 4.49Å; W54-L72 HydrophobicContact CB-CD1 4.46Å; W54-L72 HydrophobicContact CB-CD2 4.04Å; W54-L72 HydrophobicContact CD2-CD1 4.07Å; W54-L72 HydrophobicContact CG-CD1 3.96Å; W54-L72 HydrophobicContact CG-CD2 4.11Å; W54-F87 HydrophobicContact CD2-CE1 4.42Å; W54-F87 HydrophobicContact CD2-CZ 4.11Å; W54-F87 HydrophobicContact CE3-CD1 4.46Å; W54-F87 AromaticContact CE3-CE1 3.33Å; W54-F87 HydrophobicContact CE3-CE1 3.33Å; W54-F87 AromaticContact CE3-CZ 3.43Å; W54-F87 HydrophobicContact CE3-CZ 3.43Å; W54-F87 VanDerWaalsContact CE3-CZ 3.43Å; W54-F87 HydrophobicContact CZ3-CD1 4.33Å; W54-F87 AromaticContact CZ3-CE1 3.57Å; W54-F87 HydrophobicContact CZ3-CE1 3.57Å; W54-F87 AromaticContact CZ3-CZ 3.97Å; W54-F87 HydrophobicContact CZ3-CZ 3.97Å
55	L	97.6	Very high	96.8	Very high	0 Å²	0	70 Å²	70	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62.2	-37.3	178.8	179.6	64.6	0	0	0	112.5	L51 R52 D53 H58 R59 A62 W86 F87 A90 R91 L94 L95 M98	L51-L55 WeakPolarHBondContact O-CB 3.42Å; L51-L55 PolarHBondContact O-N 3.21Å; R52-L55 PolarHBondContact O-N 3.48Å; D53-L55 VanDerWaalsContact C-N 3.32Å; D53-L55 PolarHBondContact O-N 2.91Å; L55-H58 CarbonylContact O-C 3.54Å; L55-R59 VanDerWaalsContact O-CA 3.27Å; L55-R59 WeakPolarHBondContact O-CA 3.38Å; L55-R59 WeakPolarHBondContact O-CB 3.47Å; L55-R59 PolarHBondContact O-N 2.97Å; L55-A62 HydrophobicContact CD1-CB 3.63Å; L55-W86 HydrophobicContact CD2-CH2 4.29Å; L55-W86 HydrophobicContact CD2-CZ3 4.38Å; L55-F87 HydrophobicContact CB-CE1 4.25Å; L55-F87 HydrophobicContact CD1-CD1 4.4Å; L55-F87 HydrophobicContact CD1-CE1 4.3Å; L55-A90 HydrophobicContact CD2-CB 3.93Å; L55-R91 HydrophobicContact CD1-CG 4.27Å; L55-L94 HydrophobicContact CD2-CB 4.25Å; L55-L94 HydrophobicContact CD2-CD1 4.45Å; L55-L95 HydrophobicContact CD1-CD1 4.18Å; L55-M98 HydrophobicContact CD2-SD 4.43Å; L55-M98 HydrophobicContact CG-SD 4.39Å
56	Y	96.4	Very high	96.9	Very high	133 Å²	133	68.9 Å²	68.9	52%	0.522	32%	0.319	S	S	.	.	H	α-helix	trans	-69.3	-45.8	178.3	179.7	-101.9	0	0	0	111.1	R52 D53 W54 H58 R59 M98	R52-Y56 WeakPolarHBondContact O-CB 3.49Å; R52-Y56 PolarHBondContact O-N 3.45Å; D53-Y56 PolarHBondContact O-N 2.86Å; D53-Y56 VanDerWaalsContact O-N 3.16Å; W54-Y56 VanDerWaalsContact C-N 3.3Å; W54-Y56 PolarHBondContact O-N 2.99Å; Y56-H58 VanDerWaalsContact C-N 3.3Å; Y56-H58 PolarHBondContact O-N 3.08Å; Y56-R59 WeakPolarHBondContact O-CB 3.27Å; Y56-R59 WeakPolarHBondContact O-CD 3.48Å; Y56-R59 WeakPolarHBondContact O-CG 3.46Å; Y56-R59 PolarHBondContact O-N 2.9Å; Y56-M98 HydrophobicContact CD2-CE 4.07Å; Y56-M98 HydrophobicContact CD2-SD 4.43Å
57	E	97	Very high	96.9	Very high	145 Å²	145	68.8 Å²	68.8	68%	0.678	32%	0.319	S	S	*	.	H	α-helix	trans	-60.7	-40.7	176.8	-172.8	175.9	-164.5	0	0	111.7	D53 W54	D53-E57 PolarHBondContact O-N 3.02Å; W54-E57 PolarHBondContact O-N 3.37Å
58	H	96.3	Very high	96.9	Very high	54 Å²	54	70.9 Å²	70.9	25%	0.25	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	23.6	-176.6	-59.6	76.3	0	0	0	113.1	W54 L55 Y56 Y60 N61 A62 E68	W54-H58 AromaticContact CD1-CE1 3.78Å; W54-H58 AromaticContact CD1-ND1 3.76Å; W54-H58 HydrophobicContact CD2-CB 4.34Å; W54-H58 AromaticContact CD2-ND1 3.64Å; W54-H58 AromaticContact CE2-CE1 3.76Å; W54-H58 AromaticContact CE2-CG 3.63Å; W54-H58 AromaticContact CE2-ND1 3.42Å; W54-H58 HydrophobicContact CE3-CB 4.08Å; W54-H58 AromaticContact CG-ND1 3.86Å; W54-H58 HydrophobicContact CH2-CB 3.61Å; W54-H58 AromaticContact CH2-CG 3.79Å; W54-H58 HydrophobicContact CZ2-CB 3.89Å; W54-H58 AromaticContact CZ2-CD2 3.71Å; W54-H58 AromaticContact CZ2-CG 3.51Å; W54-H58 AromaticContact CZ2-ND1 3.83Å; W54-H58 HydrophobicContact CZ3-CB 3.73Å; W54-H58 AromaticContact NE1-CE1 3.42Å; W54-H58 PolarHBondContact NE1-CE1 3.4Å; W54-H58 AromaticContact NE1-ND1 3.51Å; W54-H58 AromaticContact NE1-NE2 3.92Å; W54-H58 WeakPolarHBondContact O-CB 3.22Å; W54-H58 PolarHBondContact O-N 3.4Å; W54-H58 PolarHBondContact O-ND1 3.16Å; L55-H58 CarbonylContact O-C 3.54Å; Y56-H58 VanDerWaalsContact C-N 3.3Å; Y56-H58 PolarHBondContact O-N 3.08Å; H58-Y60 PolarHBondContact O-N 2.9Å; H58-N61 CarbonylContact O-C 2.97Å; H58-N61 PolarHBondContact O-N 3.36Å; H58-A62 WeakPolarHBondContact O-CA 3.24Å; H58-A62 PolarHBondContact O-N 3.42Å; H58-E68 IonicContact NE2-OE1 3.97Å
59	R	94.4	Very high	96.9	Very high	29 Å²	29	72.7 Å²	72.7	11%	0.109	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.7	-172.3	62.1	-168.8	177.8	81.5	-4.8	115	L55 Y56 L95 L99 D102	L55-R59 VanDerWaalsContact O-CA 3.27Å; L55-R59 WeakPolarHBondContact O-CA 3.38Å; L55-R59 WeakPolarHBondContact O-CB 3.47Å; L55-R59 PolarHBondContact O-N 2.97Å; Y56-R59 WeakPolarHBondContact O-CB 3.27Å; Y56-R59 WeakPolarHBondContact O-CD 3.48Å; Y56-R59 WeakPolarHBondContact O-CG 3.46Å; Y56-R59 PolarHBondContact O-N 2.9Å; R59-L95 HydrophobicContact CB-CD1 3.67Å; R59-L95 WeakPolarHBondContact O-CD1 3.39Å; R59-L99 HydrophobicContact CB-CD1 4.04Å; R59-L99 HydrophobicContact CG-CD1 4.39Å; R59-D102 IonicContact CZ-OD1 3.34Å; R59-D102 IonicContact CZ-OD2 3.29Å; R59-D102 IonicContact NE-OD2 2.66Å; R59-D102 PolarHBondContact NE-OD2 3.23Å; R59-D102 IonicContact NH1-OD1 2.81Å; R59-D102 IonicContact NH1-OD2 3.3Å; R59-D102 PolarHBondContact NH1-OD2 3.2Å; R59-D102 IonicContact NH2-OD1 3.99Å; R59-D102 PolarHBondContact NH2-OD1 3.11Å; R59-D102 IonicContact NH2-OD2 2.59Å; R59-D102 PolarHBondContact NH2-OD2 3.15Å
60	Y	91.8	Very high	96.9	Very high	99 Å²	99	70 Å²	70	39%	0.388	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-22.7	175.5	-60.7	-66.3	0	0	0	113.6	H58 K104 F109	H58-Y60 PolarHBondContact O-N 2.9Å; Y60-K104 HydrophobicContact CE1-CD 4.4Å; Y60-K104 HydrophobicContact CE1-CG 4.24Å; Y60-F109 HydrophobicContact CD1-CD1 4.28Å; Y60-F109 AromaticContact CD1-CE1 3.95Å; Y60-F109 HydrophobicContact CD1-CE1 3.95Å; Y60-F109 HydrophobicContact CD1-CE2 4.41Å; Y60-F109 HydrophobicContact CD1-CZ 4.02Å; Y60-F109 WeakPolarHBondContact O-CD1 3.38Å
61	N	93.2	Very high	97	Very high	103 Å²	103	72.1 Å²	72.1	55%	0.551	34%	0.338	S	S	*	.	S	Bend	trans	-137.7	68.7	173.8	-177.7	29.3	0	0	0	109.7	H58 Y63	H58-N61 CarbonylContact O-C 2.97Å; H58-N61 PolarHBondContact O-N 3.36Å; N61-Y63 PolarHBondContact O-N 3.07Å
62	A	94.4	Very high	97	Very high	4 Å²	4	72.4 Å²	72.4	3%	0.033	34%	0.339	C	S	.	.			trans	-75.3	37.2	-172.6	0	0	0	0	0	113.6	L55 H58 R91 L95	L55-A62 HydrophobicContact CD1-CB 3.63Å; H58-A62 WeakPolarHBondContact O-CA 3.24Å; H58-A62 PolarHBondContact O-N 3.42Å; A62-R91 HydrophobicContact CB-CG 3.94Å; A62-R91 WeakPolarHBondContact O-CD 3.12Å; A62-R91 PolarHBondContact O-NE 3.27Å; A62-L95 HydrophobicContact CB-CD1 4.35Å; A62-L95 HydrophobicContact CB-CD2 3.53Å
63	Y	96.6	Very high	97	Very high	114 Å²	114	68.1 Å²	68.1	45%	0.447	33%	0.326	S	S	.	.			trans	-117.5	90.2	179.1	-68.2	-91	0	0	0	109.1	N61 S65 R91 I111	N61-Y63 PolarHBondContact O-N 3.07Å; Y63-S65 PolarHBondContact O-N 3.31Å; Y63-R91 PolarHBondContact OH-NH2 3.1Å; Y63-I111 WeakPolarHBondContact OH-CD1 3.16Å
64	P	97	Very high	97	Very high	9 Å²	9	71.4 Å²	71.4	6%	0.058	34%	0.337	C	S	.	.			trans	-62.7	134	178.5	24.7	-31.8	0	0	0	109.6	W54 E68 K69 F87	W54-P64 VanDerWaalsContact CH2-CA 3.45Å; W54-P64 HydrophobicContact CH2-CB 3.5Å; W54-P64 VanDerWaalsContact CH2-CB 3.5Å; W54-P64 HydrophobicContact CH2-CG 4.04Å; W54-P64 HydrophobicContact CZ2-CB 3.63Å; W54-P64 HydrophobicContact CZ3-CB 4.02Å; W54-P64 HydrophobicContact CZ3-CG 4.13Å; P64-E68 WeakPolarHBondContact CA-OE2 3.42Å; P64-E68 HydrophobicContact CB-CB 3.89Å; P64-K69 HydrophobicContact CB-CG 4.03Å; P64-K69 HydrophobicContact CG-CG 3.94Å; P64-K69 WeakPolarHBondContact O-CE 3.5Å; P64-K69 PolarHBondContact O-NZ 3.01Å; P64-F87 HydrophobicContact CG-CD1 4.28Å; P64-F87 HydrophobicContact CG-CD2 3.86Å; P64-F87 HydrophobicContact CG-CE1 4.4Å; P64-F87 HydrophobicContact CG-CE2 3.97Å; P64-F87 HydrophobicContact CG-CG 4.03Å; P64-F87 HydrophobicContact CG-CZ 4.25Å
65	S	98.3	Very high	97	Very high	54 Å²	54	75 Å²	75	38%	0.378	35%	0.354	S	S	.	.			trans	-58.7	166.3	168.9	65	0	0	0	0	111.1	Y63 Q67 E68 K69	Y63-S65 PolarHBondContact O-N 3.31Å; S65-Q67 PolarHBondContact O-N 3.19Å; S65-E68 VanDerWaalsContact CB-OE2 3.24Å; S65-E68 WeakPolarHBondContact CB-OE2 3.21Å; S65-E68 PolarHBondContact N-OE2 2.94Å; S65-E68 PolarHBondContact O-N 2.87Å; S65-E68 VanDerWaalsContact OG-CD 3.28Å; S65-E68 VanDerWaalsContact OG-CG 3.25Å; S65-E68 WeakPolarHBondContact OG-CG 3.47Å; S65-E68 PolarHBondContact OG-N 3.11Å; S65-E68 PolarHBondContact OG-OE2 3.23Å; S65-K69 VanDerWaalsContact O-CG 3.31Å; S65-K69 WeakPolarHBondContact O-CG 3.21Å; S65-K69 PolarHBondContact O-N 3.41Å
66	E	98.1	Very high	97	Very high	164 Å²	164	75.1 Å²	75.1	77%	0.766	36%	0.355	S	S	*	.	H	α-helix	trans	-56.4	-41.3	175.7	-171.1	122.5	-137.5	0	0	112	K69 A70	E66-K69 PolarHBondContact O-N 3.24Å; E66-A70 PolarHBondContact O-N 2.88Å
67	Q	98.3	Very high	97.1	Very high	148 Å²	148	76.6 Å²	76.6	69%	0.692	37%	0.367	S	S	*	.	H	α-helix	trans	-67.1	-42.8	178.4	-175.4	62.9	8.9	0	0	112.2	S65 A70 L71	S65-Q67 PolarHBondContact O-N 3.19Å; Q67-A70 WeakPolarHBondContact O-CB 3.31Å; Q67-A70 PolarHBondContact O-N 3.24Å; Q67-L71 PolarHBondContact O-N 2.72Å
68	E	98.4	Very high	97.1	Very high	55 Å²	55	70.4 Å²	70.4	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-65.6	-40.1	176.5	-71	163.7	129.8	0	0	111.3	W54 H58 P64 S65 A70 L71 L72	W54-E68 HydrophobicContact CZ2-CB 4.49Å; H58-E68 IonicContact NE2-OE1 3.97Å; P64-E68 WeakPolarHBondContact CA-OE2 3.42Å; P64-E68 HydrophobicContact CB-CB 3.89Å; S65-E68 VanDerWaalsContact CB-OE2 3.24Å; S65-E68 WeakPolarHBondContact CB-OE2 3.21Å; S65-E68 PolarHBondContact N-OE2 2.94Å; S65-E68 PolarHBondContact O-N 2.87Å; S65-E68 VanDerWaalsContact OG-CD 3.28Å; S65-E68 VanDerWaalsContact OG-CG 3.25Å; S65-E68 WeakPolarHBondContact OG-CG 3.47Å; S65-E68 PolarHBondContact OG-N 3.11Å; S65-E68 PolarHBondContact OG-OE2 3.23Å; E68-A70 VanDerWaalsContact C-N 3.3Å; E68-A70 PolarHBondContact O-N 3.42Å; E68-L71 PolarHBondContact O-N 2.99Å; E68-L72 WeakPolarHBondContact O-CB 3.48Å; E68-L72 VanDerWaalsContact O-CG 3.24Å; E68-L72 WeakPolarHBondContact O-CG 3.32Å; E68-L72 PolarHBondContact O-N 3.41Å
69	K	98.6	Very high	97.2	Very high	60 Å²	60	70.6 Å²	70.6	26%	0.261	35%	0.346	S	S	.	.	H	α-helix	trans	-59.3	-42.3	172.7	-72.2	163.2	177.6	159.4	0	111.5	P64 S65 E66 S73 T80	P64-K69 HydrophobicContact CB-CG 4.03Å; P64-K69 HydrophobicContact CG-CG 3.94Å; P64-K69 WeakPolarHBondContact O-CE 3.5Å; P64-K69 PolarHBondContact O-NZ 3.01Å; S65-K69 VanDerWaalsContact O-CG 3.31Å; S65-K69 WeakPolarHBondContact O-CG 3.21Å; S65-K69 PolarHBondContact O-N 3.41Å; E66-K69 PolarHBondContact O-N 3.24Å; K69-S73 WeakPolarHBondContact O-CB 3.35Å; K69-S73 PolarHBondContact O-N 3.27Å; K69-T80 HydrophobicContact CB-CG2 4.19Å
70	A	98.4	Very high	97.4	Very high	32 Å²	32	72.1 Å²	72.1	26%	0.264	36%	0.359	S	S	.	.	H	α-helix	trans	-65.7	-39.9	176.8	0	0	0	0	0	112	E66 Q67 E68 S73 K74	E66-A70 PolarHBondContact O-N 2.88Å; Q67-A70 WeakPolarHBondContact O-CB 3.31Å; Q67-A70 PolarHBondContact O-N 3.24Å; E68-A70 VanDerWaalsContact C-N 3.3Å; E68-A70 PolarHBondContact O-N 3.42Å; A70-S73 WeakPolarHBondContact O-CB 3.37Å; A70-K74 WeakPolarHBondContact O-CG 3.44Å; A70-K74 PolarHBondContact O-N 3.35Å; A70-K74 VanDerWaalsContact O-N 3.1Å
71	L	98.5	Very high	97.7	Very high	90 Å²	90	72.8 Å²	72.8	47%	0.471	37%	0.368	S	S	.	.	H	α-helix	trans	-64.4	-48.7	175.1	-179.4	62.2	0	0	0	111.7	Q67 E68 S73 K74 Q75	Q67-L71 PolarHBondContact O-N 2.72Å; E68-L71 PolarHBondContact O-N 2.99Å; L71-S73 VanDerWaalsContact C-N 3.31Å; L71-S73 PolarHBondContact O-N 2.67Å; L71-K74 WeakPolarHBondContact O-CB 3.44Å; L71-K74 PolarHBondContact O-N 2.91Å; L71-Q75 HydrophobicContact CD1-CG 4.49Å; L71-Q75 WeakPolarHBondContact O-CG 3.49Å; L71-Q75 PolarHBondContact O-N 2.99Å
72	L	98.6	Very high	97.9	Very high	6 Å²	6	71.4 Å²	71.4	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-63.1	-38.8	178.5	-69.6	170.1	0	0	0	111.6	I50 L51 W54 E68 Q75 T76 V83 F87	I50-L72 HydrophobicContact CG2-CD2 4.1Å; L51-L72 HydrophobicContact CD2-CB 4.1Å; L51-L72 HydrophobicContact CD2-CD1 4.31Å; L51-L72 HydrophobicContact CD2-CD2 4.33Å; L51-L72 HydrophobicContact CD2-CG 4.49Å; W54-L72 HydrophobicContact CB-CD1 4.46Å; W54-L72 HydrophobicContact CB-CD2 4.04Å; W54-L72 HydrophobicContact CD2-CD1 4.07Å; W54-L72 HydrophobicContact CG-CD1 3.96Å; W54-L72 HydrophobicContact CG-CD2 4.11Å; E68-L72 WeakPolarHBondContact O-CB 3.48Å; E68-L72 VanDerWaalsContact O-CG 3.24Å; E68-L72 WeakPolarHBondContact O-CG 3.32Å; E68-L72 PolarHBondContact O-N 3.41Å; L72-Q75 PolarHBondContact O-N 3.22Å; L72-T76 VanDerWaalsContact O-CB 3.27Å; L72-T76 WeakPolarHBondContact O-CB 3.31Å; L72-T76 VanDerWaalsContact O-CG2 3.22Å; L72-T76 WeakPolarHBondContact O-CG2 3.49Å; L72-T76 PolarHBondContact O-N 2.88Å; L72-T76 PolarHBondContact O-OG1 2.7Å; L72-V83 HydrophobicContact CB-CG1 4.15Å; L72-F87 HydrophobicContact CD1-CE2 3.62Å; L72-F87 HydrophobicContact CD1-CZ 3.73Å
73	S	98.6	Very high	98.1	Very high	21 Å²	21	71.2 Å²	71.2	15%	0.147	36%	0.357	C	S	.	.	H	α-helix	trans	-55.7	-50	171.9	167.3	0	0	0	0	111.4	K69 A70 L71 Q75 T76 Q77 L78	K69-S73 WeakPolarHBondContact O-CB 3.35Å; K69-S73 PolarHBondContact O-N 3.27Å; A70-S73 WeakPolarHBondContact O-CB 3.37Å; L71-S73 VanDerWaalsContact C-N 3.31Å; L71-S73 PolarHBondContact O-N 2.67Å; S73-Q75 PolarHBondContact O-N 3.1Å; S73-T76 PolarHBondContact O-N 3.01Å; S73-Q77 WeakPolarHBondContact O-CA 3.24Å; S73-Q77 PolarHBondContact O-N 2.7Å; S73-L78 WeakPolarHBondContact CA-O 3.25Å; S73-L78 WeakPolarHBondContact CB-O 3.41Å; S73-L78 PolarHBondContact O-N 2.6Å; S73-L78 PolarHBondContact OG-O 3.34Å
74	K	98.4	Very high	98.2	Very high	153 Å²	153	67.4 Å²	67.4	67%	0.665	35%	0.346	S	S	*	.	H	α-helix	trans	-61.9	-43.4	176.4	-70.7	175.2	-178.9	-177.2	0	112.8	A70 L71 Q77	A70-K74 WeakPolarHBondContact O-CG 3.44Å; A70-K74 PolarHBondContact O-N 3.35Å; A70-K74 VanDerWaalsContact O-N 3.1Å; L71-K74 WeakPolarHBondContact O-CB 3.44Å; L71-K74 PolarHBondContact O-N 2.91Å; K74-Q77 PolarHBondContact O-NE2 2.64Å
75	Q	98.3	Very high	98.2	Very high	101 Å²	101	70.5 Å²	70.5	47%	0.472	36%	0.362	S	S	.	.	H	α-helix	trans	-69.4	-39	-179.5	-70.1	-176.3	13.1	0	0	112.5	I50 L71 L72 S73	I50-Q75 HydrophobicContact CD1-CB 4.4Å; I50-Q75 HydrophobicContact CG2-CB 4.26Å; L71-Q75 HydrophobicContact CD1-CG 4.49Å; L71-Q75 WeakPolarHBondContact O-CG 3.49Å; L71-Q75 PolarHBondContact O-N 2.99Å; L72-Q75 PolarHBondContact O-N 3.22Å; S73-Q75 PolarHBondContact O-N 3.1Å
76	T	98.1	Very high	98.2	Very high	3 Å²	3	69.4 Å²	69.4	2%	0.018	35%	0.35	C	S	.	.	H	α-helix	trans	-90.1	-10.3	-173.8	61.3	0	0	0	0	113.9	S47 I50 L51 L72 S73 L78	S47-T76 WeakPolarHBondContact O-CG2 3.46Å; S47-T76 PolarHBondContact OG-O 2.95Å; I50-T76 HydrophobicContact CB-CG2 3.96Å; I50-T76 HydrophobicContact CD1-CG2 4.27Å; I50-T76 HydrophobicContact CG2-CG2 3.89Å; L51-T76 HydrophobicContact CD1-CG2 4.49Å; L51-T76 HydrophobicContact CD2-CG2 3.99Å; L51-T76 HydrophobicContact CG-CG2 3.9Å; L72-T76 VanDerWaalsContact O-CB 3.27Å; L72-T76 WeakPolarHBondContact O-CB 3.31Å; L72-T76 VanDerWaalsContact O-CG2 3.22Å; L72-T76 WeakPolarHBondContact O-CG2 3.49Å; L72-T76 PolarHBondContact O-N 2.88Å; L72-T76 PolarHBondContact O-OG1 2.7Å; S73-T76 PolarHBondContact O-N 3.01Å; T76-L78 PolarHBondContact O-N 2.62Å; T76-L78 WeakPolarHBondContact OG1-CG 3.18Å
77	Q	98.3	Very high	98.2	Very high	164 Å²	164	61.9 Å²	61.9	77%	0.766	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	36.3	-172.9	-58.9	-66	-37	0	0	112.4	S73 K74	S73-Q77 WeakPolarHBondContact O-CA 3.24Å; S73-Q77 PolarHBondContact O-N 2.7Å; K74-Q77 PolarHBondContact O-NE2 2.64Å
78	L	97.7	Very high	98.1	Very high	15 Å²	15	59.3 Å²	59.3	8%	0.079	31%	0.305	C	S	.	.			trans	-112.5	152	177	-60.2	176.2	0	0	0	109.4	L43 L51 S73 T76 Q82 V83	L43-L78 HydrophobicContact CD2-CD1 3.63Å; L43-L78 HydrophobicContact CD2-CD2 3.42Å; L43-L78 VanDerWaalsContact CD2-CD2 3.42Å; L43-L78 HydrophobicContact CD2-CG 4.14Å; L51-L78 HydrophobicContact CD1-CD1 4.12Å; S73-L78 WeakPolarHBondContact CA-O 3.25Å; S73-L78 WeakPolarHBondContact CB-O 3.41Å; S73-L78 PolarHBondContact O-N 2.6Å; S73-L78 PolarHBondContact OG-O 3.34Å; T76-L78 PolarHBondContact O-N 2.62Å; T76-L78 WeakPolarHBondContact OG1-CG 3.18Å; L78-Q82 HydrophobicContact CB-CB 4.15Å; L78-V83 HydrophobicContact CB-CG2 4.06Å
79	S	98.2	Very high	98	Very high	58 Å²	58	60.2 Å²	60.2	41%	0.406	31%	0.311	S	S	.	.			trans	-65	150.1	172.1	73.5	0	0	0	0	111	L81 Q82 V83	S79-L81 PolarHBondContact O-N 2.82Å; S79-L81 VanDerWaalsContact O-N 3.11Å; S79-Q82 WeakPolarHBondContact O-CA 3.5Å; S79-Q82 WeakPolarHBondContact O-CB 3.47Å; S79-Q82 PolarHBondContact O-N 2.59Å; S79-Q82 WeakPolarHBondContact OG-CG 3.41Å; S79-Q82 PolarHBondContact OG-N 3.3Å; S79-Q82 PolarHBondContact OG-OE1 3.04Å; S79-V83 PolarHBondContact O-N 3.29Å
80	T	98	Very high	97.9	Very high	62 Å²	62	57.5 Å²	57.5	38%	0.38	30%	0.3	S	S	.	.	H	α-helix	trans	-52.5	-38	176.3	-51.4	0	0	0	0	111.6	K69 V83 C84	K69-T80 HydrophobicContact CB-CG2 4.19Å; T80-V83 PolarHBondContact O-N 2.99Å; T80-C84 WeakPolarHBondContact O-CB 3.43Å; T80-C84 PolarHBondContact O-N 2.78Å; T80-C84 PolarHBondContact O-SG 3.29Å
81	L	97.7	Very high	97.8	Very high	113 Å²	113	57.2 Å²	57.2	59%	0.592	29%	0.292	S	S	*	.	H	α-helix	trans	-65.1	-39	175.4	-179.1	60.8	0	0	0	112.8	S79 N85	S79-L81 PolarHBondContact O-N 2.82Å; S79-L81 VanDerWaalsContact O-N 3.11Å; L81-N85 WeakPolarHBondContact O-CB 3.43Å; L81-N85 VanDerWaalsContact O-CG 3.28Å; L81-N85 PolarHBondContact O-N 3.42Å; L81-N85 PolarHBondContact O-ND2 3.48Å
82	Q	98	Very high	97.6	Very high	74 Å²	74	60 Å²	60	35%	0.346	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-42.1	174.3	-74.6	168.9	-54.7	0	0	111.2	L78 S79 N85 W86	L78-Q82 HydrophobicContact CB-CB 4.15Å; S79-Q82 WeakPolarHBondContact O-CA 3.5Å; S79-Q82 WeakPolarHBondContact O-CB 3.47Å; S79-Q82 PolarHBondContact O-N 2.59Å; S79-Q82 WeakPolarHBondContact OG-CG 3.41Å; S79-Q82 PolarHBondContact OG-N 3.3Å; S79-Q82 PolarHBondContact OG-OE1 3.04Å; Q82-N85 PolarHBondContact O-N 3.42Å; Q82-W86 WeakPolarHBondContact O-CB 3.27Å; Q82-W86 PolarHBondContact O-N 3.39Å
83	V	98.4	Very high	97.4	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-50.7	174.8	176.9	0	0	0	0	110.5	L51 L72 L78 S79 T80 N85 W86 F87	L51-V83 HydrophobicContact CD2-CG1 4.08Å; L72-V83 HydrophobicContact CB-CG1 4.15Å; L78-V83 HydrophobicContact CB-CG2 4.06Å; S79-V83 PolarHBondContact O-N 3.29Å; T80-V83 PolarHBondContact O-N 2.99Å; V83-N85 PolarHBondContact O-N 3.16Å; V83-W86 WeakPolarHBondContact O-CB 3.31Å; V83-W86 PolarHBondContact O-N 3.41Å; V83-W86 VanDerWaalsContact O-N 3.16Å; V83-F87 HydrophobicContact CG1-CD2 3.8Å; V83-F87 HydrophobicContact CG1-CE2 3.73Å; V83-F87 VanDerWaalsContact O-CD2 3.31Å; V83-F87 WeakPolarHBondContact O-CD2 3.46Å; V83-F87 PolarHBondContact O-N 2.91Å
84	C	98.1	Very high	97.3	Very high	33 Å²	33	69.9 Å²	69.9	22%	0.223	33%	0.334	C	S	.	.	H	α-helix	trans	-55.1	-49.5	176.4	-71.6	0	0	0	0	112.3	T80 W86 F87 I88	T80-C84 WeakPolarHBondContact O-CB 3.43Å; T80-C84 PolarHBondContact O-N 2.78Å; T80-C84 PolarHBondContact O-SG 3.29Å; C84-W86 VanDerWaalsContact C-N 3.3Å; C84-W86 PolarHBondContact O-N 2.96Å; C84-F87 PolarHBondContact O-N 3.04Å; C84-I88 WeakPolarHBondContact O-CG1 3.23Å; C84-I88 PolarHBondContact O-N 3.13Å; C84-I88 VanDerWaalsContact O-N 3.08Å
85	N	97.8	Very high	97	Very high	74 Å²	74	62.6 Å²	62.6	40%	0.396	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-37.6	179.1	-76.6	-45.9	0	0	0	112.4	L81 Q82 V83 I88 N89	L81-N85 WeakPolarHBondContact O-CB 3.43Å; L81-N85 VanDerWaalsContact O-CG 3.28Å; L81-N85 PolarHBondContact O-N 3.42Å; L81-N85 PolarHBondContact O-ND2 3.48Å; Q82-N85 PolarHBondContact O-N 3.42Å; V83-N85 PolarHBondContact O-N 3.16Å; N85-I88 PolarHBondContact O-N 2.88Å; N85-N89 PolarHBondContact O-N 3.17Å; N85-N89 VanDerWaalsContact O-N 3.17Å
86	W	97.9	Very high	96.7	Very high	31 Å²	31	59.3 Å²	59.3	12%	0.117	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-47	176.1	-172.7	91	0	0	0	110.9	L43 V48 L51 R52 L55 Q82 V83 C84 I88 N89 A90 L94	L43-W86 HydrophobicContact CD1-CB 4.46Å; L43-W86 HydrophobicContact CD1-CG 4.2Å; V48-W86 HydrophobicContact CG1-CZ2 4.13Å; L51-W86 HydrophobicContact CB-CD2 4.01Å; L51-W86 HydrophobicContact CB-CE3 3.68Å; L51-W86 HydrophobicContact CB-CH2 3.53Å; L51-W86 HydrophobicContact CB-CZ2 3.84Å; L51-W86 HydrophobicContact CB-CZ3 3.45Å; L51-W86 VanDerWaalsContact CB-CZ3 3.45Å; L51-W86 HydrophobicContact CD1-CB 4.28Å; L51-W86 HydrophobicContact CD1-CD2 3.61Å; L51-W86 HydrophobicContact CD1-CE3 3.93Å; L51-W86 HydrophobicContact CD1-CG 3.77Å; L51-W86 HydrophobicContact CG-CD2 4.4Å; L51-W86 HydrophobicContact CG-CE3 4.29Å; R52-W86 HydrophobicContact CG-CH2 3.9Å; R52-W86 HydrophobicContact CG-CZ2 3.9Å; L55-W86 HydrophobicContact CD2-CH2 4.29Å; L55-W86 HydrophobicContact CD2-CZ3 4.38Å; Q82-W86 WeakPolarHBondContact O-CB 3.27Å; Q82-W86 PolarHBondContact O-N 3.39Å; V83-W86 WeakPolarHBondContact O-CB 3.31Å; V83-W86 PolarHBondContact O-N 3.41Å; V83-W86 VanDerWaalsContact O-N 3.16Å; C84-W86 VanDerWaalsContact C-N 3.3Å; C84-W86 PolarHBondContact O-N 2.96Å; W86-I88 PolarHBondContact O-N 3.08Å; W86-N89 PolarHBondContact O-N 2.87Å; W86-N89 VanDerWaalsContact O-N 3.13Å; W86-A90 HydrophobicContact CD2-CB 4.04Å; W86-A90 HydrophobicContact CE3-CB 3.7Å; W86-A90 HydrophobicContact CH2-CB 3.67Å; W86-A90 HydrophobicContact CZ2-CB 4.01Å; W86-A90 HydrophobicContact CZ3-CB 3.49Å; W86-A90 VanDerWaalsContact CZ3-CB 3.49Å; W86-A90 VanDerWaalsContact O-CB 3.23Å; W86-A90 WeakPolarHBondContact O-CB 3.36Å; W86-A90 PolarHBondContact O-N 3.41Å; W86-L94 HydrophobicContact CZ2-CD1 4.49Å
87	F	98.1	Very high	96.4	Very high	7 Å²	7	63.9 Å²	63.9	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-40.1	178.1	-86.3	-74	0	0	0	113	L51 W54 L55 P64 L72 V83 C84 N89 A90 R91	L51-F87 HydrophobicContact CD2-CE2 3.79Å; L51-F87 HydrophobicContact CD2-CZ 4.22Å; W54-F87 HydrophobicContact CD2-CE1 4.42Å; W54-F87 HydrophobicContact CD2-CZ 4.11Å; W54-F87 HydrophobicContact CE3-CD1 4.46Å; W54-F87 AromaticContact CE3-CE1 3.33Å; W54-F87 HydrophobicContact CE3-CE1 3.33Å; W54-F87 AromaticContact CE3-CZ 3.43Å; W54-F87 HydrophobicContact CE3-CZ 3.43Å; W54-F87 VanDerWaalsContact CE3-CZ 3.43Å; W54-F87 HydrophobicContact CZ3-CD1 4.33Å; W54-F87 AromaticContact CZ3-CE1 3.57Å; W54-F87 HydrophobicContact CZ3-CE1 3.57Å; W54-F87 AromaticContact CZ3-CZ 3.97Å; W54-F87 HydrophobicContact CZ3-CZ 3.97Å; L55-F87 HydrophobicContact CB-CE1 4.25Å; L55-F87 HydrophobicContact CD1-CD1 4.4Å; L55-F87 HydrophobicContact CD1-CE1 4.3Å; P64-F87 HydrophobicContact CG-CD1 4.28Å; P64-F87 HydrophobicContact CG-CD2 3.86Å; P64-F87 HydrophobicContact CG-CE1 4.4Å; P64-F87 HydrophobicContact CG-CE2 3.97Å; P64-F87 HydrophobicContact CG-CG 4.03Å; P64-F87 HydrophobicContact CG-CZ 4.25Å; L72-F87 HydrophobicContact CD1-CE2 3.62Å; L72-F87 HydrophobicContact CD1-CZ 3.73Å; V83-F87 HydrophobicContact CG1-CD2 3.8Å; V83-F87 HydrophobicContact CG1-CE2 3.73Å; V83-F87 VanDerWaalsContact O-CD2 3.31Å; V83-F87 WeakPolarHBondContact O-CD2 3.46Å; V83-F87 PolarHBondContact O-N 2.91Å; C84-F87 PolarHBondContact O-N 3.04Å; F87-N89 VanDerWaalsContact C-N 3.27Å; F87-N89 PolarHBondContact O-N 3.02Å; F87-A90 PolarHBondContact O-N 3.36Å; F87-R91 VanDerWaalsContact O-CB 3.31Å; F87-R91 WeakPolarHBondContact O-CB 3.38Å; F87-R91 WeakPolarHBondContact O-CD 3.35Å; F87-R91 WeakPolarHBondContact O-CG 3.35Å; F87-R91 PolarHBondContact O-N 3.36Å
88	I	95.9	Very high	96.1	Very high	94 Å²	94	58 Å²	58	48%	0.482	28%	0.284	S	S	.	.	H	α-helix	trans	-57.7	-43.9	174.4	-67	167	0	0	0	110.7	C84 N85 W86 R92	C84-I88 WeakPolarHBondContact O-CG1 3.23Å; C84-I88 PolarHBondContact O-N 3.13Å; C84-I88 VanDerWaalsContact O-N 3.08Å; N85-I88 PolarHBondContact O-N 2.88Å; W86-I88 PolarHBondContact O-N 3.08Å; I88-R92 WeakPolarHBondContact O-CD 3.43Å; I88-R92 WeakPolarHBondContact O-CG 3.33Å
89	N	96.8	Very high	95.7	Very high	73 Å²	73	57.2 Å²	57.2	39%	0.39	28%	0.28	S	S	.	.	H	α-helix	trans	-73.7	-45.4	-179.6	-166.5	-95.9	0	0	0	112.4	N85 W86 F87 R91 R92 R93	N85-N89 PolarHBondContact O-N 3.17Å; N85-N89 VanDerWaalsContact O-N 3.17Å; W86-N89 PolarHBondContact O-N 2.87Å; W86-N89 VanDerWaalsContact O-N 3.13Å; F87-N89 VanDerWaalsContact C-N 3.27Å; F87-N89 PolarHBondContact O-N 3.02Å; N89-R91 PolarHBondContact O-N 2.78Å; N89-R92 PolarHBondContact O-N 3.11Å; N89-R92 VanDerWaalsContact O-N 3.15Å; N89-R93 PolarHBondContact O-N 3.06Å; N89-R93 WeakPolarHBondContact OD1-CD 3.3Å
90	A	96.8	Very high	95.4	Very high	3 Å²	3	62.8 Å²	62.8	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-43.4	-177.1	0	0	0	0	0	111.5	L55 W86 F87 R92 R93 L94 L95	L55-A90 HydrophobicContact CD2-CB 3.93Å; W86-A90 HydrophobicContact CD2-CB 4.04Å; W86-A90 HydrophobicContact CE3-CB 3.7Å; W86-A90 HydrophobicContact CH2-CB 3.67Å; W86-A90 HydrophobicContact CZ2-CB 4.01Å; W86-A90 HydrophobicContact CZ3-CB 3.49Å; W86-A90 VanDerWaalsContact CZ3-CB 3.49Å; W86-A90 VanDerWaalsContact O-CB 3.23Å; W86-A90 WeakPolarHBondContact O-CB 3.36Å; W86-A90 PolarHBondContact O-N 3.41Å; F87-A90 PolarHBondContact O-N 3.36Å; A90-R92 PolarHBondContact O-N 3.45Å; A90-R93 PolarHBondContact O-N 3.32Å; A90-R93 VanDerWaalsContact O-N 3.11Å; A90-L94 HydrophobicContact CB-CD1 4.14Å; A90-L94 WeakPolarHBondContact O-CB 3.12Å; A90-L94 PolarHBondContact O-N 3.37Å; A90-L95 PolarHBondContact O-N 3.18Å
91	R	96.3	Very high	95	Very high	27 Å²	27	67.4 Å²	67.4	10%	0.102	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-28.5	175.7	-68.9	169.5	67.8	-133.6	-20.6	113.5	L55 A62 Y63 F87 N89 L95 P96	L55-R91 HydrophobicContact CD1-CG 4.27Å; A62-R91 HydrophobicContact CB-CG 3.94Å; A62-R91 WeakPolarHBondContact O-CD 3.12Å; A62-R91 PolarHBondContact O-NE 3.27Å; Y63-R91 PolarHBondContact OH-NH2 3.1Å; F87-R91 VanDerWaalsContact O-CB 3.31Å; F87-R91 WeakPolarHBondContact O-CB 3.38Å; F87-R91 WeakPolarHBondContact O-CD 3.35Å; F87-R91 WeakPolarHBondContact O-CG 3.35Å; F87-R91 PolarHBondContact O-N 3.36Å; N89-R91 PolarHBondContact O-N 2.78Å; R91-L95 HydrophobicContact CB-CD2 4.25Å; R91-L95 HydrophobicContact CG-CD2 4.14Å; R91-L95 WeakPolarHBondContact O-CB 3.45Å; R91-P96 WeakPolarHBondContact O-CD 3.38Å
92	R	94	Very high	94.4	Very high	148 Å²	148	64.2 Å²	64.2	56%	0.558	29%	0.29	S	S	*	.	H	α-helix	trans	-83.1	-20.6	178.3	-70	174.6	62	170	2.3	113.5	I88 N89 A90 R113	I88-R92 WeakPolarHBondContact O-CD 3.43Å; I88-R92 WeakPolarHBondContact O-CG 3.33Å; N89-R92 PolarHBondContact O-N 3.11Å; N89-R92 VanDerWaalsContact O-N 3.15Å; A90-R92 PolarHBondContact O-N 3.45Å; R92-R113 PolarHBondContact O-NH1 2.67Å
93	R	94.9	Very high	93.8	Very high	180 Å²	180	64 Å²	64	68%	0.679	31%	0.308	S	S	*	.	H	α-helix	trans	-116.6	-36	-170.1	-67.3	-172.9	176.2	-174.3	-5.1	114.1	N89 A90	N89-R93 PolarHBondContact O-N 3.06Å; N89-R93 WeakPolarHBondContact OD1-CD 3.3Å; A90-R93 PolarHBondContact O-N 3.32Å; A90-R93 VanDerWaalsContact O-N 3.11Å
94	L	94.9	Very high	93.1	Very high	54 Å²	54	68 Å²	68	28%	0.283	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-42.6	-173	-53.4	-177.9	0	0	0	111.6	R52 L55 W86 A90 E97 M98	R52-L94 HydrophobicContact CG-CD1 4.39Å; L55-L94 HydrophobicContact CD2-CB 4.25Å; L55-L94 HydrophobicContact CD2-CD1 4.45Å; W86-L94 HydrophobicContact CZ2-CD1 4.49Å; A90-L94 HydrophobicContact CB-CD1 4.14Å; A90-L94 WeakPolarHBondContact O-CB 3.12Å; A90-L94 PolarHBondContact O-N 3.37Å; L94-E97 PolarHBondContact O-N 3.39Å; L94-M98 PolarHBondContact O-N 3.24Å; L94-M98 VanDerWaalsContact O-N 3.09Å
95	L	93.1	Very high	92.2	Very high	1 Å²	1	72.3 Å²	72.3	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-61.2	-39.2	-174.5	-167.7	62.3	0	0	0	114.6	L55 R59 A62 A90 R91 E97 M98 L99 T110	L55-L95 HydrophobicContact CD1-CD1 4.18Å; R59-L95 HydrophobicContact CB-CD1 3.67Å; R59-L95 WeakPolarHBondContact O-CD1 3.39Å; A62-L95 HydrophobicContact CB-CD1 4.35Å; A62-L95 HydrophobicContact CB-CD2 3.53Å; A90-L95 PolarHBondContact O-N 3.18Å; R91-L95 HydrophobicContact CB-CD2 4.25Å; R91-L95 HydrophobicContact CG-CD2 4.14Å; R91-L95 WeakPolarHBondContact O-CB 3.45Å; L95-E97 VanDerWaalsContact C-N 3.3Å; L95-E97 PolarHBondContact O-N 3.42Å; L95-M98 PolarHBondContact O-N 3.24Å; L95-L99 HydrophobicContact CD1-CD1 3.76Å; L95-L99 HydrophobicContact CG-CD1 4.09Å; L95-L99 PolarHBondContact O-N 3.44Å; L95-T110 HydrophobicContact CB-CG2 4.38Å; L95-T110 HydrophobicContact CD2-CG2 3.97Å; L95-T110 HydrophobicContact CG-CG2 4.07Å
96	P	92.1	Very high	91.3	Very high	32 Å²	32	69.8 Å²	69.8	21%	0.208	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-38.5	176.5	-23.9	34.6	0	0	0	113	R91 R100 P106 T110	R91-P96 WeakPolarHBondContact O-CD 3.38Å; P96-R100 VanDerWaalsContact O-CG 3.3Å; P96-R100 WeakPolarHBondContact O-CG 3.14Å; P96-R100 PolarHBondContact O-N 2.98Å; P96-R100 VanDerWaalsContact O-N 3.12Å; P96-P106 HydrophobicContact CB-CB 3.98Å; P96-P106 HydrophobicContact CB-CG 4.34Å; P96-T110 HydrophobicContact CG-CG2 4.25Å
97	E	91.2	Very high	90.3	Very high	98 Å²	98	74 Å²	74	46%	0.458	36%	0.359	S	S	.	.	H	α-helix	trans	-69.8	-41.2	178.4	-179.7	56.2	-148.3	0	0	111	L94 L95 L99 R100 K101	L94-E97 PolarHBondContact O-N 3.39Å; L95-E97 VanDerWaalsContact C-N 3.3Å; L95-E97 PolarHBondContact O-N 3.42Å; E97-L99 PolarHBondContact O-N 3.45Å; E97-R100 PolarHBondContact O-N 3.48Å; E97-K101 WeakPolarHBondContact O-CG 3.31Å; E97-K101 PolarHBondContact O-N 3.29Å; E97-K101 WeakPolarHBondContact OE1-CE 3.38Å
98	M	91.9	Very high	89.2	Confident	40 Å²	40	80.7 Å²	80.7	20%	0.197	39%	0.39	C	S	.	.	H	α-helix	trans	-58.6	-47.8	174.5	-70.7	173	154.5	0	0	111.1	L55 Y56 L94 L95 R100 K101 D102	L55-M98 HydrophobicContact CD2-SD 4.43Å; L55-M98 HydrophobicContact CG-SD 4.39Å; Y56-M98 HydrophobicContact CD2-CE 4.07Å; Y56-M98 HydrophobicContact CD2-SD 4.43Å; L94-M98 PolarHBondContact O-N 3.24Å; L94-M98 VanDerWaalsContact O-N 3.09Å; L95-M98 PolarHBondContact O-N 3.24Å; M98-R100 PolarHBondContact O-N 2.99Å; M98-K101 WeakPolarHBondContact O-CB 3.12Å; M98-K101 PolarHBondContact O-N 3.09Å; M98-D102 PolarHBondContact O-N 3.2Å
99	L	90.6	Very high	88.3	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-65.3	-38.4	-178.9	-98.3	64.2	0	0	0	114.1	R59 L95 E97 K101 D102 G103 K104 F109	R59-L99 HydrophobicContact CB-CD1 4.04Å; R59-L99 HydrophobicContact CG-CD1 4.39Å; L95-L99 HydrophobicContact CD1-CD1 3.76Å; L95-L99 HydrophobicContact CG-CD1 4.09Å; L95-L99 PolarHBondContact O-N 3.44Å; E97-L99 PolarHBondContact O-N 3.45Å; L99-K101 VanDerWaalsContact C-N 3.29Å; L99-K101 PolarHBondContact O-N 3.38Å; L99-D102 PolarHBondContact O-N 3.41Å; L99-G103 PolarHBondContact O-N 3.44Å; L99-K104 CarbonylContact C-O 3.42Å; L99-K104 HydrophobicContact CG-CB 4.45Å; L99-K104 PolarHBondContact O-N 3.12Å; L99-F109 HydrophobicContact CD2-CB 3.46Å; L99-F109 VanDerWaalsContact CD2-CB 3.46Å; L99-F109 HydrophobicContact CD2-CD2 3.36Å; L99-F109 HydrophobicContact CD2-CE2 4.38Å; L99-F109 HydrophobicContact CD2-CG 3.71Å; L99-F109 HydrophobicContact CG-CD2 4.43Å
100	R	91.2	Very high	87.4	Confident	174 Å²	174	76.9 Å²	76.9	66%	0.657	37%	0.369	S	S	*	.	H	α-helix	trans	-60.2	-39.8	175.3	-75.7	169.2	60.6	122.2	4.2	111.9	P96 E97 M98 D102 G103 P106	P96-R100 VanDerWaalsContact O-CG 3.3Å; P96-R100 WeakPolarHBondContact O-CG 3.14Å; P96-R100 PolarHBondContact O-N 2.98Å; P96-R100 VanDerWaalsContact O-N 3.12Å; E97-R100 PolarHBondContact O-N 3.48Å; M98-R100 PolarHBondContact O-N 2.99Å; R100-D102 PolarHBondContact O-N 2.76Å; R100-G103 PolarHBondContact O-N 2.77Å; R100-P106 HydrophobicContact CG-CG 3.55Å
101	K	89.3	Confident	86.1	Confident	159 Å²	159	82.4 Å²	82.4	69%	0.691	40%	0.397	S	S	*	.	H	α-helix	trans	-63	-32.7	177.7	-72.1	177.6	176.2	-173.9	0	112.5	E97 M98 L99 G103	E97-K101 WeakPolarHBondContact O-CG 3.31Å; E97-K101 PolarHBondContact O-N 3.29Å; E97-K101 WeakPolarHBondContact OE1-CE 3.38Å; M98-K101 WeakPolarHBondContact O-CB 3.12Å; M98-K101 PolarHBondContact O-N 3.09Å; L99-K101 VanDerWaalsContact C-N 3.29Å; L99-K101 PolarHBondContact O-N 3.38Å; K101-G103 PolarHBondContact O-N 3.5Å
102	D	85.9	Confident	84.4	Confident	46 Å²	46	83.9 Å²	83.9	25%	0.246	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	1.5	176.8	-57	-61.4	0	0	0	113.5	R59 M98 L99 R100 K104	R59-D102 IonicContact CZ-OD1 3.34Å; R59-D102 IonicContact CZ-OD2 3.29Å; R59-D102 IonicContact NE-OD2 2.66Å; R59-D102 PolarHBondContact NE-OD2 3.23Å; R59-D102 IonicContact NH1-OD1 2.81Å; R59-D102 IonicContact NH1-OD2 3.3Å; R59-D102 PolarHBondContact NH1-OD2 3.2Å; R59-D102 IonicContact NH2-OD1 3.99Å; R59-D102 PolarHBondContact NH2-OD1 3.11Å; R59-D102 IonicContact NH2-OD2 2.59Å; R59-D102 PolarHBondContact NH2-OD2 3.15Å; M98-D102 PolarHBondContact O-N 3.2Å; L99-D102 PolarHBondContact O-N 3.41Å; R100-D102 PolarHBondContact O-N 2.76Å; D102-K104 HydrophobicContact CB-CD 3.96Å; D102-K104 WeakPolarHBondContact O-CD 3.48Å; D102-K104 PolarHBondContact O-NZ 2.8Å
103	G	85.2	Confident	82.9	Confident	69 Å²	69	85 Å²	85	71%	0.711	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	21.8	-178.2	0	0	0	0	0	114.4	L99 R100 K101	L99-G103 PolarHBondContact O-N 3.44Å; R100-G103 PolarHBondContact O-N 2.77Å; K101-G103 PolarHBondContact O-N 3.5Å
104	K	82.9	Confident	80.9	Confident	84 Å²	84	84.9 Å²	84.9	37%	0.365	42%	0.419	S	S	.	.			trans	-106.1	143.2	179.9	-78.8	73.7	-178.1	175.3	0	110	Y60 L99 D102 P106 F109	Y60-K104 HydrophobicContact CE1-CD 4.4Å; Y60-K104 HydrophobicContact CE1-CG 4.24Å; L99-K104 CarbonylContact C-O 3.42Å; L99-K104 HydrophobicContact CG-CB 4.45Å; L99-K104 PolarHBondContact O-N 3.12Å; D102-K104 HydrophobicContact CB-CD 3.96Å; D102-K104 WeakPolarHBondContact O-CD 3.48Å; D102-K104 PolarHBondContact O-NZ 2.8Å; K104-P106 VanDerWaalsContact O-CD 3.29Å; K104-P106 WeakPolarHBondContact O-CD 3.49Å; K104-F109 HydrophobicContact CB-CE2 4.19Å; K104-F109 HydrophobicContact CG-CE2 4.3Å
105	D	78.8	Confident	78.9	Confident	124 Å²	124	85.8 Å²	85.8	66%	0.663	44%	0.442	S	S	*	.			trans	-67.5	120.5	177	-73	-39.7	0	0	0	111	N107 Q108	D105-N107 PolarHBondContact O-N 2.96Å; D105-N107 VanDerWaalsContact O-N 3.1Å; D105-Q108 PolarHBondContact O-N 3.36Å; D105-Q108 VanDerWaalsContact O-N 3.14Å
106	P	80	Confident	76.8	Confident	22 Å²	22	90.3 Å²	90.3	14%	0.143	47%	0.474	C	S	.	.	H	α-helix	trans	-57.8	-29	179	-29.3	38.6	0	0	0	113.5	P96 R100 K104 Q108 F109 T110	P96-P106 HydrophobicContact CB-CB 3.98Å; P96-P106 HydrophobicContact CB-CG 4.34Å; R100-P106 HydrophobicContact CG-CG 3.55Å; K104-P106 VanDerWaalsContact O-CD 3.29Å; K104-P106 WeakPolarHBondContact O-CD 3.49Å; P106-Q108 PolarHBondContact O-N 3.49Å; P106-F109 PolarHBondContact O-N 2.75Å; P106-T110 VanDerWaalsContact O-CB 3.32Å; P106-T110 WeakPolarHBondContact O-CB 3.29Å; P106-T110 WeakPolarHBondContact O-CG2 3.32Å; P106-T110 PolarHBondContact O-N 3.21Å; P106-T110 PolarHBondContact O-OG1 2.85Å
107	N	77.5	Confident	74.8	Confident	120 Å²	120	99.4 Å²	99.4	64%	0.642	51%	0.51	S	S	*	.	H	α-helix	trans	-69.2	-18.5	-176.3	-71.3	18.4	0	0	0	113	D105	D105-N107 PolarHBondContact O-N 2.96Å; D105-N107 VanDerWaalsContact O-N 3.1Å
108	Q	74.8	Confident	72.7	Confident	147 Å²	147	98.3 Å²	98.3	69%	0.687	52%	0.518	S	S	*	.	H	α-helix	trans	-79.3	-29.9	179.5	-172.1	175.3	52.7	0	0	112.7	D105 P106	D105-Q108 PolarHBondContact O-N 3.36Å; D105-Q108 VanDerWaalsContact O-N 3.14Å; P106-Q108 PolarHBondContact O-N 3.49Å
109	F	75.3	Confident	70.5	Confident	62 Å²	62	99.4 Å²	99.4	27%	0.272	54%	0.539	S	S	.	.	H	α-helix	trans	-120.2	-8	-172.7	-55.9	-86.4	0	0	0	113.7	Y60 L99 K104 P106	Y60-F109 HydrophobicContact CD1-CD1 4.28Å; Y60-F109 AromaticContact CD1-CE1 3.95Å; Y60-F109 HydrophobicContact CD1-CE1 3.95Å; Y60-F109 HydrophobicContact CD1-CE2 4.41Å; Y60-F109 HydrophobicContact CD1-CZ 4.02Å; Y60-F109 WeakPolarHBondContact O-CD1 3.38Å; L99-F109 HydrophobicContact CD2-CB 3.46Å; L99-F109 VanDerWaalsContact CD2-CB 3.46Å; L99-F109 HydrophobicContact CD2-CD2 3.36Å; L99-F109 HydrophobicContact CD2-CE2 4.38Å; L99-F109 HydrophobicContact CD2-CG 3.71Å; L99-F109 HydrophobicContact CG-CD2 4.43Å; K104-F109 HydrophobicContact CB-CE2 4.19Å; K104-F109 HydrophobicContact CG-CE2 4.3Å; P106-F109 PolarHBondContact O-N 2.75Å
110	T	79.8	Confident	68.7	Low	24 Å²	24	105.8 Å²	105.8	15%	0.147	57%	0.573	C	S	.	*	S	Bend	trans	-109.3	145.2	175	71.8	0	0	0	0	110.1	L95 P96 P106 S112	L95-T110 HydrophobicContact CB-CG2 4.38Å; L95-T110 HydrophobicContact CD2-CG2 3.97Å; L95-T110 HydrophobicContact CG-CG2 4.07Å; P96-T110 HydrophobicContact CG-CG2 4.25Å; P106-T110 VanDerWaalsContact O-CB 3.32Å; P106-T110 WeakPolarHBondContact O-CB 3.29Å; P106-T110 WeakPolarHBondContact O-CG2 3.32Å; P106-T110 PolarHBondContact O-N 3.21Å; P106-T110 PolarHBondContact O-OG1 2.85Å; T110-S112 PolarHBondContact O-N 3.38Å
111	I	68.9	Low	66.7	Low	120 Å²	120	102.7 Å²	102.7	62%	0.615	58%	0.578	S	S	*	*			trans	-59.7	107.1	171.3	-71.5	166.7	0	0	0	106.5	Y63 R113	Y63-I111 WeakPolarHBondContact OH-CD1 3.16Å; I111-R113 PolarHBondContact O-N 3.1Å; I111-R113 VanDerWaalsContact O-N 3.1Å
112	S	61.2	Low	64.8	Low	57 Å²	57	102.9 Å²	102.9	40%	0.399	58%	0.58	S	S	.	*			trans	-50.4	121.1	179.5	-92.1	0	0	0	0	108.5	T110 K114	T110-S112 PolarHBondContact O-N 3.38Å; S112-K114 PolarHBondContact O-N 3.14Å
113	R	61	Low	62.9	Low	172 Å²	172	106.3 Å²	106.3	65%	0.649	61%	0.607	S	S	*	*			trans	-72.2	60.4	164.9	-66.1	-159	-71.3	-114	7.9	108.4	R92 I111 G115	R92-R113 PolarHBondContact O-NH1 2.67Å; I111-R113 PolarHBondContact O-N 3.1Å; I111-R113 VanDerWaalsContact O-N 3.1Å; R113-G115 PolarHBondContact O-N 2.96Å
114	K	52.8	Low	61.1	Low	177 Å²	177	109.1 Å²	109.1	77%	0.77	61%	0.606	S	S	*	*			trans	-77.2	72.7	173.1	-168.8	113.8	166.5	-168.4	0	107.9	S112	S112-K114 PolarHBondContact O-N 3.14Å
115	G	54.6	Low	59.3	Low	73 Å²	73	110.7 Å²	110.7	75%	0.753	63%	0.627	S	S	*	*			trans	-125.6	25	167.6	0	0	0	0	0	110.8	R113	R113-G115 PolarHBondContact O-N 2.96Å
116	S	47.7	Very low	58	Low	97 Å²	97	109.6 Å²	109.6	68%	0.678	63%	0.629	S	S	*	*	S	Bend	trans	-135.6	118.6	170.9	-57.7	0	0	0	0	107.7	A118	S116-A118 VanDerWaalsContact C-N 3.3Å; S116-A118 PolarHBondContact O-N 3.28Å
117	K	49.9	Very low	56.4	Low	222 Å²	222	117.3 Å²	117.3	97%	0.965	66%	0.663	S	S	*	*			trans	-56.7	88.7	173	-177.5	178.3	170.3	115.8	0	109.3
118	A	47	Very low	54.6	Low	76 Å²	76	117 Å²	117	63%	0.628	67%	0.671	S	S	*	*			trans	-108.8	106	150.4	0	0	0	0	0	103.4	S116	S116-A118 VanDerWaalsContact C-N 3.3Å; S116-A118 PolarHBondContact O-N 3.28Å
119	G	47.3	Very low	53.4	Low	62 Å²	62	115 Å²	115	64%	0.639	67%	0.671	S	S	*	*				85	96.3	65.9	0	0	0	0	0	104.5	S121	G119-S121 PolarHBondContact O-N 3.39Å
120	D	51.4	Low	51.8	Low	134 Å²	134	121.8 Å²	121.8	72%	0.717	70%	0.7	S	S	*	*			trans	-30.3	122.2	177.9	-166.7	-131.9	0	0	0	113.3	F122	D120-F122 WeakPolarHBondContact OD1-CD1 3.36Å; D120-F122 WeakPolarHBondContact OD1-CE1 3.26Å
121	S	49	Very low	49.8	Very low	109 Å²	109	128.7 Å²	128.7	76%	0.762	73%	0.73	S	S	*	*			trans	-146.1	83.7	163.3	-79.6	0	0	0	0	106.7	G119 S123	G119-S121 PolarHBondContact O-N 3.39Å; S121-S123 PolarHBondContact O-N 2.87Å
122	F	49.9	Very low	48.3	Very low	164 Å²	164	128.2 Å²	128.2	72%	0.719	74%	0.737	S	S	*	*			trans	-46.2	116.9	149	47.1	-85.7	0	0	0	108.8	D120	D120-F122 WeakPolarHBondContact OD1-CD1 3.36Å; D120-F122 WeakPolarHBondContact OD1-CE1 3.26Å
123	S	46.3	Very low	47.3	Very low	118 Å²	118	131 Å²	131	83%	0.825	76%	0.757	S	S	*	*			trans	-120.7	91.6	153.3	-88	0	0	0	0	106.5	S121 S125	S121-S123 PolarHBondContact O-N 2.87Å; S123-S125 PolarHBondContact O-N 3.27Å
124	D	47.1	Very low	46.5	Very low	128 Å²	128	128.9 Å²	128.9	68%	0.684	77%	0.765	S	S	*	*			trans	-57.3	122.4	152	171.1	39.7	0	0	0	108.1	S126	D124-S126 PolarHBondContact OD1-N 3.1Å; D124-S126 PolarHBondContact OD1-OG 2.8Å
125	S	45.5	Very low	45.6	Very low	116 Å²	116	125 Å²	125	81%	0.811	77%	0.766	S	S	*	*			trans	-150.3	75.1	159	-86.4	0	0	0	0	107.7	S123 Q127	S123-S125 PolarHBondContact O-N 3.27Å; S125-Q127 PolarHBondContact O-N 3.33Å
126	S	51.2	Low	44.8	Very low	101 Å²	101	126.7 Å²	126.7	71%	0.706	77%	0.773	S	S	*	*			trans	-61	99.4	157.2	-53.7	0	0	0	0	109.6	D124	D124-S126 PolarHBondContact OD1-N 3.1Å; D124-S126 PolarHBondContact OD1-OG 2.8Å
127	Q	47	Very low	44.2	Very low	184 Å²	184	125.6 Å²	125.6	86%	0.86	78%	0.778	S	S	*	*			trans	-139.5	101.7	156	-72.7	-160.5	5.5	0	0	111	S125	S125-Q127 PolarHBondContact O-N 3.33Å
128	S	40.2	Very low	43.7	Very low	115 Å²	115	119.4 Å²	119.4	80%	0.804	77%	0.768	S	S	*	*			trans	-62.6	143.5	154.4	-67.5	0	0	0	0	110.2
129	P	48.2	Very low	43.3	Very low	105 Å²	105	124 Å²	124	68%	0.682	78%	0.776	S	S	*	*			trans	-117.2	118.5	140.2	-2.6	23.5	0	0	0	110.5	H131	P129-H131 PolarHBondContact O-N 3.44Å
130	K	41.5	Very low	42.8	Very low	204 Å²	204	129.7 Å²	129.7	89%	0.887	79%	0.786	S	S	*	*			trans	-62.5	118.3	163.9	-64	173.8	176.7	176.3	0	107.9
131	H	38	Very low	42.1	Very low	169 Å²	169	127 Å²	127	78%	0.782	78%	0.783	S	S	*	*			trans	-121	114.9	160.2	-79.4	-76.5	0	0	0	109.3	P129	P129-H131 PolarHBondContact O-N 3.44Å
132	S	37.9	Very low	41.4	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	78%	0.782	S	S	*	*			trans	-56.2	128.8	168.6	45.9	0	0	0	0	111.6
133	S	39.3	Very low	40.6	Very low	115 Å²	115	124.3 Å²	124.3	80%	0.804	77%	0.774	S	S	*	*			trans	-61.2	150	158.3	-52.4	0	0	0	0	110.7
134	P	44.3	Very low	40.4	Very low	128 Å²	128	125 Å²	125	83%	0.831	76%	0.762	S	S	*	*			trans	-124	127.5	130.8	32.7	-22.9	0	0	0	110
135	A	35.4	Very low	39.9	Very low	96 Å²	96	129.4 Å²	129.4	79%	0.793	77%	0.77	S	S	*	*			trans	-97.7	123.3	170.4	0	0	0	0	0	109.3
136	A	36.8	Very low	39.4	Very low	109 Å²	109	126.8 Å²	126.8	90%	0.901	76%	0.755	S	S	*	*			trans	37	129.9	142.9	0	0	0	0	0	121.4
137	G	34.5	Very low	38.7	Very low	74 Å²	74	130.7 Å²	130.7	76%	0.763	76%	0.76	S	S	*	*			trans	155.2	95.4	147.3	0	0	0	0	0	113.5
138	A	40.7	Very low	38.2	Very low	92 Å²	92	129.9 Å²	129.9	76%	0.76	76%	0.756	S	S	*	*			trans	174.1	95.7	146.3	0	0	0	0	0	111.2
139	E	37.4	Very low	38.9	Very low	171 Å²	171	130 Å²	130	80%	0.799	75%	0.753	S	S	*	*			trans	11.5	145.8	134.1	-12.9	-66.6	98.7	0	0	121.8
140	E	37.3	Very low	38.8	Very low	183 Å²	183	130 Å²	130	86%	0.855	76%	0.757	S	S	*	*			trans	107	134.7	136.9	-85.2	-72.2	152.9	0	0	122.4
141	A	36.4	Very low	38.5	Very low	78 Å²	78	126.1 Å²	126.1	65%	0.645	76%	0.755	S	S	*	*			trans	86	98.8	152.3	0	0	0	0	0	122.8
142	C	34.6	Very low	38.7	Very low	111 Å²	111	127 Å²	127	75%	0.75	76%	0.757	S	S	*	*				20.7	140	120	-122	0	0	0	0	118
143	D	33.8	Very low	38.9	Very low	104 Å²	104	127.5 Å²	127.5	56%	0.556	75%	0.751	S	S	*	*			cis	179.4	150.8	49.5	-136.4	-33.3	0	0	0	111.8
144	K	41	Very low	40	Very low	132 Å²	132	126.6 Å²	126.6	57%	0.574	74%	0.742	S	S	*	*			trans	57.7	125.7	140.9	-82.7	154.1	-157.9	143.3	0	124.3
145	R	36.7	Very low	39.5	Very low	221 Å²	221	126.1 Å²	126.1	83%	0.834	74%	0.742	S	S	*	*			trans	77.3	152	131.2	-70.9	172.8	-175.2	141.5	-1.5	117
146	A	34.6	Very low	39.9	Very low	62 Å²	62	128.9 Å²	128.9	51%	0.512	74%	0.742	S	S	.	*			cis	177.1	160.5	-19.3	0	0	0	0	0	104.8
147	F	37.5	Very low	40.6	Very low	183 Å²	183	129.4 Å²	129.4	80%	0.803	74%	0.736	S	S	*	*			trans	85.9	103.5	161	-50.9	-70	0	0	0	119.8
148	H	37.1	Very low	40.6	Very low	167 Å²	167	130.8 Å²	130.8	77%	0.773	73%	0.734	S	S	*	*			trans	-27.2	-177.8	140.4	-13.6	-100	0	0	0	116.5
149	P	54.5	Low	40.4	Very low	116 Å²	116	132.7 Å²	132.7	75%	0.753	74%	0.736	S	S	*	*			cis	-138.2	178.5	-33	34.4	-13.8	0	0	0	114.1
150	S	46.4	Very low	40.6	Very low	107 Å²	107	130.2 Å²	130.2	75%	0.748	73%	0.727	S	S	*	*			trans	39.1	126.7	139.6	173.3	0	0	0	0	122.5
151	S	35.3	Very low	40.8	Very low	122 Å²	122	131.5 Å²	131.5	85%	0.853	73%	0.725	S	S	*	*			trans	-160.9	119.4	131.3	-92.6	0	0	0	0	114.7
152	F	41.3	Very low	40.9	Very low	186 Å²	186	137.3 Å²	137.3	82%	0.816	74%	0.735	S	S	*	*			trans	-36.3	155.2	138.6	-121.9	-120.5	0	0	0	111.7
153	D	41.3	Very low	41.7	Very low	121 Å²	121	136.8 Å²	136.8	65%	0.647	73%	0.73	S	S	*	*			cis	-176.2	-152.4	30.2	-162.1	5.6	0	0	0	109.7
154	P	63.5	Low	41.8	Very low	95 Å²	95	138.2 Å²	138.2	62%	0.617	74%	0.742	S	S	*	*				-113.9	-176.1	-117.3	37.7	-17.6	0	0	0	114.6
155	S	34.7	Very low	41.7	Very low	119 Å²	119	136.6 Å²	136.6	83%	0.832	75%	0.748	S	S	*	*				168.5	137	127.3	-73.8	0	0	0	0	113.9
156	I	42.8	Very low	41.7	Very low	153 Å²	153	135.1 Å²	135.1	79%	0.785	75%	0.75	S	S	*	*			trans	-107.9	148.5	171.3	-75.9	-83.4	0	0	0	106.6
157	P	50.9	Low	41.9	Very low	120 Å²	120	136.7 Å²	136.7	78%	0.779	76%	0.757	S	S	*	*				-149.4	149	95.4	31.1	-8	0	0	0	118.9
158	S	35.8	Very low	41.8	Very low	104 Å²	104	135.9 Å²	135.9	73%	0.727	76%	0.758	S	S	*	*			trans	16	149.1	139.1	-55.8	0	0	0	0	120
159	V	35.4	Very low	41.7	Very low	131 Å²	131	133.3 Å²	133.3	79%	0.794	76%	0.759	S	S	*	*				-168	151.1	55.9	-148.1	0	0	0	0	106.9
160	L	42.1	Very low	41	Very low	119 Å²	119	133.4 Å²	133.4	62%	0.623	76%	0.762	S	S	*	*				169.1	125	92.8	-159.8	64.9	0	0	0	112.7
161	R	42.2	Very low	41.2	Very low	211 Å²	211	133.7 Å²	133.7	80%	0.796	76%	0.761	S	S	*	*			trans	48.7	116.9	147.6	-59.5	-179.6	-130.3	158.4	3.7	120.4
162	K	36.7	Very low	41.1	Very low	200 Å²	200	134.2 Å²	134.2	87%	0.87	76%	0.759	S	S	*	*				77.9	154	62.7	-156.2	99.5	175.1	-178.5	0	113.7
163	P	52	Low	40.8	Very low	99 Å²	99	130.6 Å²	130.6	64%	0.643	76%	0.757	S	S	*	*				-128.2	175.8	-67.2	41.1	-26.4	0	0	0	113.2
164	V	36.6	Very low	40.4	Very low	134 Å²	134	130.7 Å²	130.7	81%	0.812	77%	0.767	S	S	*	*			trans	-153.2	130.6	139.4	153.5	0	0	0	0	109.5
165	S	39.3	Very low	39.2	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	78%	0.776	S	S	*	*			trans	-87.7	148	174.8	-47.2	0	0	0	0	110.7
166	H	35.2	Very low	39.9	Very low	190 Å²	190	131.3 Å²	131.3	88%	0.88	77%	0.771	S	S	*	*			trans	-146.2	127.5	138	-82.7	-72.7	0	0	0	109.9
167	S	38.4	Very low	39.7	Very low	95 Å²	95	129.6 Å²	129.6	66%	0.664	77%	0.773	S	S	*	*			trans	-118.1	-177.2	176.8	-169.3	0	0	0	0	108
168	M	35.9	Very low	39.6	Very low	166 Å²	166	130 Å²	130	82%	0.818	78%	0.775	S	S	*	*			trans	83.5	129.5	-179.5	-37.6	-48.4	160.8	0	0	112.7
169	S	34.8	Very low	39.4	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	77%	0.774	S	S	*	*			cis	-173.2	142.4	24.1	30.8	0	0	0	0	110.3
170	S	39.7	Very low	39.6	Very low	118 Å²	118	130.2 Å²	130.2	83%	0.825	78%	0.779	S	S	*	*			trans	-82.4	156.6	146.4	-59.3	0	0	0	0	108.8
171	P	50.5	Low	39.8	Very low	112 Å²	112	132 Å²	132	73%	0.727	79%	0.788	S	S	*	*				-152	154.8	95.2	36.6	-17	0	0	0	117
172	V	34.3	Very low	39.8	Very low	133 Å²	133	127.8 Å²	127.8	81%	0.806	79%	0.788	S	S	*	*				83.2	117.7	129.8	80.9	0	0	0	0	123.1
173	S	34.3	Very low	40	Very low	110 Å²	110	125.6 Å²	125.6	77%	0.769	79%	0.785	S	S	*	*			trans	37.1	118.5	135.9	-151.1	0	0	0	0	121
174	S	33.7	Very low	39.7	Very low	123 Å²	123	131.5 Å²	131.5	86%	0.86	80%	0.795	S	S	*	*			trans	-173.8	115.9	131.7	49.6	0	0	0	0	112.4
175	S	38.3	Very low	40.2	Very low	116 Å²	116	130.2 Å²	130.2	81%	0.811	79%	0.789	S	S	*	*			trans	-140.3	151.4	150.4	-152.4	0	0	0	0	104.3
176	P	48.2	Very low	40.5	Very low	111 Å²	111	130.3 Å²	130.3	72%	0.721	79%	0.79	S	S	*	*			cis	-142.5	171	28.6	39.5	-19.8	0	0	0	115.6
177	S	39	Very low	40.9	Very low	118 Å²	118	127.1 Å²	127.1	83%	0.825	78%	0.783	S	S	*	*			trans	-179.4	159.3	135	-87.4	0	0	0	0	113.6
178	P	48.6	Very low	41.1	Very low	128 Å²	128	129 Å²	129	83%	0.831	78%	0.784	S	S	*	*			trans	-111	157.9	-150.9	39.2	-28.6	0	0	0	114.6
179	G	32.5	Very low	41.4	Very low	67 Å²	67	126.5 Å²	126.5	69%	0.691	78%	0.782	S	S	*	*			trans	161	140.6	169.7	0	0	0	0	0	109.2
180	L	38.3	Very low	41.7	Very low	172 Å²	172	128.3 Å²	128.3	90%	0.901	78%	0.778	S	S	*	*			cis	-148.9	138.7	7.8	-76.2	162.4	0	0	0	106.2	P182	L180-P182 WeakPolarHBondContact O-CD 3.44Å
181	I	47.5	Very low	42	Very low	158 Å²	158	129 Å²	129	81%	0.81	78%	0.777	S	S	*	*			trans	-76.7	124.8	172	-57.8	169.7	0	0	0	107.6	N183	I181-N183 PolarHBondContact O-N 2.84Å; I181-N183 VanDerWaalsContact O-N 3.1Å
182	P	41.9	Very low	41.8	Very low	122 Å²	122	128.6 Å²	128.6	79%	0.792	77%	0.773	S	S	*	*			trans	-72	106.4	163.6	-15.3	30.8	0	0	0	108.7	L180 R184	L180-P182 WeakPolarHBondContact O-CD 3.44Å; P182-R184 PolarHBondContact O-N 3.36Å; P182-R184 VanDerWaalsContact O-N 3.1Å
183	N	40	Very low	42	Very low	154 Å²	154	128.1 Å²	128.1	82%	0.824	77%	0.77	S	S	*	*			trans	-57.3	106.4	172.4	-162.6	32	0	0	0	109.4	I181	I181-N183 PolarHBondContact O-N 2.84Å; I181-N183 VanDerWaalsContact O-N 3.1Å
184	R	46.3	Very low	42.2	Very low	222 Å²	222	128.3 Å²	128.3	84%	0.838	77%	0.767	S	S	*	*			trans	-87.5	118.5	175.4	-156	-178.8	-167.1	-94.8	1.4	107.9	P182 S186	P182-R184 PolarHBondContact O-N 3.36Å; P182-R184 VanDerWaalsContact O-N 3.1Å; R184-S186 PolarHBondContact O-N 3.37Å; R184-S186 VanDerWaalsContact O-N 3.11Å
185	P	47	Very low	42.7	Very low	108 Å²	108	128.8 Å²	128.8	70%	0.701	77%	0.765	S	S	*	*			trans	-67.1	115.1	175.1	25.9	-31.4	0	0	0	109.4	V187	P185-V187 PolarHBondContact O-N 3.07Å
186	S	46.1	Very low	42.6	Very low	100 Å²	100	127.6 Å²	127.6	70%	0.699	76%	0.762	S	S	*	*			trans	-77.5	111.6	171.1	-172.6	0	0	0	0	108.3	R184	R184-S186 PolarHBondContact O-N 3.37Å; R184-S186 VanDerWaalsContact O-N 3.11Å
187	V	42.6	Very low	42.5	Very low	123 Å²	123	130.4 Å²	130.4	75%	0.745	77%	0.77	S	S	*	*			trans	-95.8	92.6	170.2	-173.7	0	0	0	0	107.5	P185	P185-V187 PolarHBondContact O-N 3.07Å
188	I	43.9	Very low	42.5	Very low	134 Å²	134	134 Å²	134	69%	0.687	77%	0.774	S	S	*	*			trans	-96.9	97.5	162.5	-62.2	172.4	0	0	0	105.8	H190	I188-H190 PolarHBondContact O-N 3.46Å; I188-H190 PolarHBondContact O-ND1 2.99Å
189	C	41.2	Very low	41.7	Very low	114 Å²	114	132.2 Å²	132.2	77%	0.77	77%	0.77	S	S	*	*			trans	-73.7	102.9	167.8	21.1	0	0	0	0	108.6
190	H	42.8	Very low	41.8	Very low	151 Å²	151	134.5 Å²	134.5	70%	0.699	78%	0.775	S	S	*	*			trans	-74.7	118.9	164	39.5	-83.2	0	0	0	107.7	I188 T192	I188-H190 PolarHBondContact O-N 3.46Å; I188-H190 PolarHBondContact O-ND1 2.99Å; H190-T192 PolarHBondContact O-N 2.97Å
191	T	45.1	Very low	42.1	Very low	132 Å²	132	131.7 Å²	131.7	81%	0.81	77%	0.767	S	S	*	*			trans	-76.7	104.6	171.6	-171.8	0	0	0	0	107.9
192	T	45.6	Very low	41.4	Very low	104 Å²	104	130.3 Å²	130.3	64%	0.638	77%	0.766	S	S	*	*			trans	-89.5	108.8	169.6	-56	0	0	0	0	107.2	H190 T194	H190-T192 PolarHBondContact O-N 2.97Å; T192-T194 PolarHBondContact O-N 3.22Å
193	V	39	Very low	40.8	Very low	123 Å²	123	128.8 Å²	128.8	75%	0.745	76%	0.763	S	S	*	*			trans	-80.5	101.3	165.8	176.9	0	0	0	0	106.7	T195	V193-T195 PolarHBondContact O-N 3.49Å
194	T	39.4	Very low	40.5	Very low	114 Å²	114	127 Å²	127	70%	0.699	76%	0.763	S	S	*	*			trans	-78.4	111.7	169.4	-72.6	0	0	0	0	108.8	T192	T192-T194 PolarHBondContact O-N 3.22Å
195	T	44.3	Very low	39.9	Very low	134 Å²	134	124.6 Å²	124.6	82%	0.822	76%	0.761	S	S	*	*			trans	-73.5	122.7	158.9	34.4	0	0	0	0	108.8	V193	V193-T195 PolarHBondContact O-N 3.49Å
196	A	36.1	Very low	39.9	Very low	90 Å²	90	125.7 Å²	125.7	74%	0.744	77%	0.768	S	S	*	*			trans	-124.1	121.7	168.7	0	0	0	0	0	109.1
197	L	46.3	Very low	39.3	Very low	170 Å²	170	125.5 Å²	125.5	89%	0.89	77%	0.767	S	S	*	*			trans	-84.4	168.6	173.1	-79.6	159.8	0	0	0	111.1
198	Q	37.6	Very low	39.1	Very low	195 Å²	195	126.7 Å²	126.7	91%	0.911	77%	0.774	S	S	*	*			trans	89.9	133.2	169.9	-86.5	171.8	44.3	0	0	116.5
199	A	32.3	Very low	39.2	Very low	90 Å²	90	125.9 Å²	125.9	74%	0.744	78%	0.778	S	S	*	*			cis	-156.1	156.2	13.3	0	0	0	0	0	111.6
200	S	35	Very low	38.9	Very low	114 Å²	114	124 Å²	124	80%	0.797	78%	0.777	S	S	*	*			trans	-67.4	167.8	173.9	-42.9	0	0	0	0	113.1
201	P	44	Very low	38.7	Very low	113 Å²	113	125.6 Å²	125.6	73%	0.734	79%	0.787	S	S	*	*				-146.3	147	91.3	37.3	-19.7	0	0	0	116.6
202	T	32.5	Very low	38.2	Very low	130 Å²	130	127 Å²	127	80%	0.798	79%	0.79	S	S	*	*			trans	51.5	115.8	141.7	59	0	0	0	0	121
203	A	30.5	Very low	38.2	Very low	89 Å²	89	127.2 Å²	127.2	74%	0.736	79%	0.794	S	S	*	*				163.4	135.2	96.6	0	0	0	0	0	113.2
204	S	32.2	Very low	37.9	Very low	116 Å²	116	128.6 Å²	128.6	81%	0.811	80%	0.797	S	S	*	*			trans	63.7	106.9	150.9	44.2	0	0	0	0	121.5
205	H	35.5	Very low	37.8	Very low	173 Å²	173	134.4 Å²	134.4	80%	0.801	81%	0.806	S	S	*	*			trans	-72.6	163.5	145.2	-65.8	-97.6	0	0	0	110.1
206	P	46.1	Very low	37.1	Very low	131 Å²	131	132 Å²	132	85%	0.851	80%	0.8	S	S	*	*				-133.6	151.8	73.5	23.9	-2.7	0	0	0	115.6
207	S	33.8	Very low	37	Very low	96 Å²	96	132.2 Å²	132.2	67%	0.671	80%	0.802	S	S	*	*			trans	-66.6	155.7	171	-49.9	0	0	0	0	114.2
208	V	37.9	Very low	36.6	Very low	147 Å²	147	132.8 Å²	132.8	89%	0.891	80%	0.8	S	S	*	*				-169	161	126.2	-96.4	0	0	0	0	111.7
209	P	45.6	Very low	36.6	Very low	118 Å²	118	132 Å²	132	77%	0.766	80%	0.801	S	S	*	*			trans	-117.7	165.3	-137.1	42.4	-33.4	0	0	0	116.5
210	G	34.8	Very low	37	Very low	74 Å²	74	134.5 Å²	134.5	76%	0.763	80%	0.801	S	S	*	*			trans	51.2	111.7	138.9	0	0	0	0	0	120.3
211	M	39.4	Very low	37	Very low	185 Å²	185	137.1 Å²	137.1	91%	0.911	80%	0.801	S	S	*	*			trans	-149	151	149.6	-18	178.6	78	0	0	111.3
212	N	34.1	Very low	36.6	Very low	162 Å²	162	137.1 Å²	137.1	87%	0.866	80%	0.804	S	S	*	*			trans	-88	178.2	-162.7	-54.7	-48	0	0	0	114
213	C	46.5	Very low	36.8	Very low	108 Å²	108	137.4 Å²	137.4	73%	0.73	81%	0.805	S	S	*	*			trans	-60.5	160.9	179.2	49.5	0	0	0	0	116.9
214	D	32.6	Very low	37.3	Very low	151 Å²	151	142.7 Å²	142.7	81%	0.807	81%	0.814	S	S	*	*			trans	77.9	111.2	160.7	-74.2	-73.5	0	0	0	119.8
215	R	36.8	Very low	37.6	Very low	236 Å²	236	141 Å²	141	89%	0.891	81%	0.807	S	S	*	*				150.1	135.5	101.7	-162.6	173.9	-172.2	117.3	-1.2	114.3
216	A	30.2	Very low	37.8	Very low	83 Å²	83	142.2 Å²	142.2	69%	0.686	81%	0.813	S	S	*	*			trans	66.1	116.4	153.8	0	0	0	0	0	118.4
217	A	34.3	Very low	37.2	Very low	95 Å²	95	140.5 Å²	140.5	79%	0.785	81%	0.81	S	S	*	*				71.5	134.7	74.4	0	0	0	0	0	113.1
218	E	36	Very low	37.4	Very low	183 Å²	183	144 Å²	144	86%	0.855	82%	0.818	S	S	*	*			trans	88.7	89.2	177.7	-60.4	-94.8	120.6	0	0	116.7
219	L	39.1	Very low	37.2	Very low	177 Å²	177	146.5 Å²	146.5	93%	0.927	82%	0.817	S	S	*	*				-159.7	81.6	124.2	-106	169.5	0	0	0	109
220	L	39.2	Very low	36.8	Very low	144 Å²	144	152.4 Å²	152.4	75%	0.754	82%	0.824	S	S	*	*			trans	-67.8	159.7	152.9	-122.3	73.8	0	0	0	108.7
221	Q	35.2	Very low	36.6	Very low	169 Å²	169	154.9 Å²	154.9	79%	0.79	83%	0.828	S	S	*	*			trans	95.9	81.5	162.2	-125	78.3	21.7	0	0	118.3
222	S	36.4	Very low	36.2	Very low	113 Å²	113	156.4 Å²	156.4	79%	0.79	82%	0.824	S	S	*	*	S	Bend	trans	160	121.6	137.7	56	0	0	0	0	106.8
223	V	37.5	Very low	36.1	Very low	135 Å²	135	153.6 Å²	153.6	82%	0.818	81%	0.809	S	S	*	*			cis	-151.5	116.9	27.7	172.9	0	0	0	0	106.2
224	Q	40.4	Very low	35.4	Very low	201 Å²	201	156.4 Å²	156.4	94%	0.939	81%	0.811	S	S	*	*			trans	-124.4	96.4	164.1	-167.8	175.2	18.9	0	0	106.4
225	A	37.2	Very low	35.3	Very low	79 Å²	79	152.2 Å²	152.2	65%	0.653	80%	0.804	S	S	*	*			trans	-177.6	105.9	156.7	0	0	0	0	0	110.4
226	Q	40	Very low	36.1	Very low	200 Å²	200	146.2 Å²	146.2	94%	0.935	80%	0.796	S	S	*	*			trans	158.3	134.5	139.4	-89	170.1	41	0	0	107.7
227	A	33.8	Very low	36.3	Very low	95 Å²	95	149.8 Å²	149.8	79%	0.785	80%	0.802	S	S	*	*			cis	-166.8	141	-16.3	0	0	0	0	0	104.4
228	M	37.4	Very low	36.2	Very low	170 Å²	170	150.6 Å²	150.6	84%	0.837	80%	0.802	S	S	*	*			trans	-68.8	163.9	171.7	-73.1	-91.2	-78.7	0	0	111.4
229	F	34.4	Very low	36.2	Very low	198 Å²	198	147 Å²	147	87%	0.868	80%	0.804	S	S	*	*			trans	97.5	104.6	170.9	-68.6	-86.8	0	0	0	117.4
230	R	36.6	Very low	36	Very low	242 Å²	242	144 Å²	144	91%	0.913	79%	0.793	S	S	*	*				-178.3	136.7	91.5	-85.1	-146.9	-172.8	-147.1	3.4	111.9
231	C	30.9	Very low	35.7	Very low	126 Å²	126	143 Å²	143	85%	0.851	79%	0.793	S	S	*	*			trans	-65.4	153.3	163.1	-65.1	0	0	0	0	112
232	R	30.8	Very low	35.6	Very low	217 Å²	217	140 Å²	140	82%	0.819	79%	0.786	S	S	*	*				132.6	137.4	117.2	-171.6	163.8	158.6	-177.5	-13	115.6
233	D	33.7	Very low	35.6	Very low	104 Å²	104	140.8 Å²	140.8	56%	0.556	78%	0.78	S	S	*	*			trans	39.4	130.5	156.7	-69.7	149.2	0	0	0	122
234	E	30.9	Very low	35.5	Very low	167 Å²	167	142.2 Å²	142.2	78%	0.78	78%	0.782	S	S	*	*				159.1	126.1	101.8	-80.6	-58.4	133.2	0	0	106.9
235	G	30.7	Very low	35.2	Very low	63 Å²	63	137.3 Å²	137.3	65%	0.649	77%	0.77	S	S	*	*			trans	-78.9	-158	161.5	0	0	0	0	0	110.2
236	P	54	Low	34.9	Very low	110 Å²	110	138.7 Å²	138.7	71%	0.714	78%	0.775	S	S	*	*			cis	-134.1	-165.1	-27.8	27.2	-3.9	0	0	0	111.3
237	L	34.5	Very low	34.5	Very low	158 Å²	158	135.4 Å²	135.4	83%	0.827	77%	0.769	S	S	*	*			trans	92.2	126.3	154.5	-37.2	176.2	0	0	0	119.6
238	S	31.6	Very low	34.5	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	76%	0.764	S	S	*	*			trans	80.3	108.6	141.4	-143.8	0	0	0	0	119.4
239	A	36.9	Very low	34.7	Very low	107 Å²	107	135.6 Å²	135.6	88%	0.884	76%	0.764	S	S	*	*			trans	-149.7	107.1	144.1	0	0	0	0	0	110.6
240	T	33.1	Very low	35.3	Very low	114 Å²	114	135.7 Å²	135.7	70%	0.699	77%	0.767	S	S	*	*			trans	-70.4	169.5	173	-65.3	0	0	0	0	112.4
241	T	33.8	Very low	35.1	Very low	124 Å²	124	127.9 Å²	127.9	76%	0.761	76%	0.762	S	S	*	*			trans	88.4	130.9	154	-87.5	0	0	0	0	115.5
242	T	33.2	Very low	35.3	Very low	106 Å²	106	128.9 Å²	128.9	65%	0.65	76%	0.759	S	S	*	*			cis	-169.8	136.8	19.5	-103.6	0	0	0	0	113.4
243	I	36.7	Very low	35.8	Very low	128 Å²	128	125.6 Å²	125.6	66%	0.656	76%	0.757	S	S	*	*			trans	48.2	125	131.6	-48.3	-67.9	0	0	0	122
244	L	34.4	Very low	36	Very low	165 Å²	165	126.3 Å²	126.3	86%	0.864	77%	0.77	S	S	*	*				-164.1	125.5	108.7	-115.7	123	0	0	0	112.6
245	S	34.5	Very low	36.8	Very low	99 Å²	99	124.4 Å²	124.4	69%	0.692	77%	0.772	S	S	*	*			trans	-91.7	146.8	176.9	-47.4	0	0	0	0	111
246	S	31	Very low	37.5	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	78%	0.783	S	S	*	*			trans	-166.7	107.5	150.7	-76.1	0	0	0	0	113.6
247	T	30.8	Very low	37.3	Very low	132 Å²	132	131.5 Å²	131.5	81%	0.81	78%	0.779	S	S	*	*			trans	49.8	114.8	132.2	71.1	0	0	0	0	123.8
248	S	34.4	Very low	37.7	Very low	96 Å²	96	127.8 Å²	127.8	67%	0.671	78%	0.778	S	S	*	*				71	135.4	116.3	-156.1	0	0	0	0	124.7
249	M	42.4	Very low	38.9	Very low	172 Å²	172	129.2 Å²	129.2	85%	0.847	78%	0.776	S	S	*	*			trans	78.8	129.9	148.4	72	-117.8	173.5	0	0	123.3
250	E	46.3	Very low	39.7	Very low	201 Å²	201	133 Å²	133	94%	0.939	77%	0.773	S	S	*	*			trans	-58.3	150.2	169.3	-73.8	162.3	93.8	0	0	114.1
251	G	32.3	Very low	40.9	Very low	77 Å²	77	135.5 Å²	135.5	79%	0.794	78%	0.782	S	S	*	*			trans	159.8	78.1	164.5	0	0	0	0	0	116.8
252	N	35.2	Very low	42.2	Very low	148 Å²	148	134.9 Å²	134.9	79%	0.791	78%	0.779	S	S	*	*			trans	37.7	143.4	141.3	-145.8	7.2	0	0	0	123.8
253	L	40.5	Very low	43.4	Very low	148 Å²	148	135.2 Å²	135.2	78%	0.775	78%	0.782	S	S	*	*			trans	91.6	102.8	157.6	-50.5	177.6	0	0	0	120
254	S	37.8	Very low	45.1	Very low	118 Å²	118	134.4 Å²	134.4	83%	0.825	79%	0.785	S	S	*	*				133.7	135.5	128.4	-150.2	0	0	0	0	114.9	R256	S254-R256 PolarHBondContact O-N 3.02Å
255	P	49	Very low	46.7	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	78%	0.782	S	S	*	*			trans	-92	106.9	-164.5	34.4	-28.1	0	0	0	111.4
256	R	45.4	Very low	48.6	Very low	233 Å²	233	133.8 Å²	133.8	88%	0.879	79%	0.787	S	S	*	*			trans	-111.8	101.3	173.3	-144.5	-178.3	163.2	169.5	-4.4	110.2	S254	S254-R256 PolarHBondContact O-N 3.02Å
257	S	49.1	Very low	50.4	Low	89 Å²	89	133.7 Å²	133.7	62%	0.622	78%	0.783	S	S	*	*			trans	44.1	78.6	145.3	55.8	0	0	0	0	116.8	L259	S257-L259 VanDerWaalsContact C-N 3.29Å; S257-L259 PolarHBondContact O-N 3.25Å
258	G	42.9	Very low	51.8	Low	79 Å²	79	132.9 Å²	132.9	81%	0.814	78%	0.781	S	S	*	*			trans	-86.9	60.5	162.7	0	0	0	0	0	112
259	L	56.9	Low	52.9	Low	142 Å²	142	134.5 Å²	134.5	74%	0.743	78%	0.782	S	S	*	*			trans	-68.5	148.2	151.5	-87.2	113.2	0	0	0	107	S257	S257-L259 VanDerWaalsContact C-N 3.29Å; S257-L259 PolarHBondContact O-N 3.25Å
260	F	54.4	Low	53.7	Low	188 Å²	188	134.3 Å²	134.3	83%	0.825	78%	0.783	S	S	*	*			trans	88.1	64	-171.1	-55.6	-80	0	0	0	115.3
261	N	57.2	Low	54.2	Low	165 Å²	165	129.4 Å²	129.4	88%	0.882	77%	0.767	S	S	*	*			trans	-121.9	62.1	147.6	-105.5	-68.7	0	0	0	108.9
262	T	61.5	Low	55.7	Low	112 Å²	112	133 Å²	133	69%	0.687	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-101.5	122.1	162.3	46.8	0	0	0	0	107.2
263	P	59.3	Low	57.6	Low	112 Å²	112	132.1 Å²	132.1	73%	0.727	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-56.8	145.7	172.3	24.9	-32.3	0	0	0	109.3
264	P	72.3	Confident	59.3	Low	111 Å²	111	132.4 Å²	132.4	72%	0.721	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-55.7	144.9	179.3	23.9	-33.1	0	0	0	109.9	T266	P264-T266 PolarHBondContact O-N 3.37Å; P264-T266 VanDerWaalsContact O-N 3.15Å
265	P	67.2	Low	61.5	Low	122 Å²	122	130.6 Å²	130.6	79%	0.792	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-56.3	124.1	174.6	24.4	-32.5	0	0	0	108.7
266	T	73.4	Confident	63.3	Low	129 Å²	129	126.9 Å²	126.9	79%	0.791	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-52.7	127.3	172.9	-44.2	0	0	0	0	108.2	P264	P264-T266 PolarHBondContact O-N 3.37Å; P264-T266 VanDerWaalsContact O-N 3.15Å
267	P	69.1	Low	65.3	Low	105 Å²	105	122.4 Å²	122.4	68%	0.682	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-56.9	144.1	174.6	22.5	-31	0	0	0	109.5	D269	P267-D269 PolarHBondContact O-N 3.46Å
268	P	61.8	Low	67.1	Low	116 Å²	116	123.1 Å²	123.1	75%	0.753	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-57.9	125.7	176.2	24.7	-32.1	0	0	0	108.3	L270	P268-L270 PolarHBondContact O-N 3.4Å
269	D	56.4	Low	69.5	Low	129 Å²	129	124.9 Å²	124.9	69%	0.69	70%	0.697	S	S	*	*			trans	-59.6	105.1	175.4	-162.9	33.6	0	0	0	107.6	P267 T271	P267-D269 PolarHBondContact O-N 3.46Å; D269-T271 PolarHBondContact O-N 3.34Å; D269-T271 PolarHBondContact OD1-OG1 3.26Å; D269-T271 PolarHBondContact OD2-OG1 3.05Å
270	L	60.1	Low	71.3	Confident	168 Å²	168	124.1 Å²	124.1	88%	0.88	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	33.1	-175.2	-154.7	82.6	0	0	0	111.4	P268	P268-L270 PolarHBondContact O-N 3.4Å
271	T	56.3	Low	73.3	Confident	98 Å²	98	117.5 Å²	117.5	60%	0.601	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.9	32.8	180	53.1	0	0	0	0	111.3	D269 D273	D269-T271 PolarHBondContact O-N 3.34Å; D269-T271 PolarHBondContact OD1-OG1 3.26Å; D269-T271 PolarHBondContact OD2-OG1 3.05Å; T271-D273 VanDerWaalsContact C-N 3.29Å; T271-D273 PolarHBondContact O-N 3.4Å
272	Q	64.4	Low	75	Confident	152 Å²	152	113.6 Å²	113.6	71%	0.71	65%	0.647	S	S	*	*			trans	-66.4	98	156.7	-86.9	-165.5	-49.1	0	0	108	F274	Q272-F274 WeakPolarHBondContact O-CD2 3.44Å; Q272-F274 PolarHBondContact O-N 3.32Å; Q272-F274 VanDerWaalsContact O-N 3.13Å
273	D	73.6	Confident	76.7	Confident	131 Å²	131	112.6 Å²	112.6	70%	0.701	64%	0.64	S	S	*	*			trans	-65.3	108.5	167.8	57	-35.2	0	0	0	108.4	T271 S275	T271-D273 VanDerWaalsContact C-N 3.29Å; T271-D273 PolarHBondContact O-N 3.4Å; D273-S275 PolarHBondContact O-N 2.87Å
274	F	77.8	Confident	78.4	Confident	154 Å²	154	110 Å²	110	68%	0.675	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	17.3	174.7	-65	-84.4	0	0	0	113.3	Q272 G276 F277 Q278	Q272-F274 WeakPolarHBondContact O-CD2 3.44Å; Q272-F274 PolarHBondContact O-N 3.32Å; Q272-F274 VanDerWaalsContact O-N 3.13Å; F274-G276 VanDerWaalsContact C-N 3.25Å; F274-G276 PolarHBondContact O-N 3.46Å; F274-F277 HydrophobicContact CB-CB 4.49Å; F274-F277 WeakPolarHBondContact O-CB 3.41Å; F274-F277 PolarHBondContact O-N 3.35Å; F274-Q278 PolarHBondContact O-N 3.4Å
275	S	82.6	Confident	79.5	Confident	80 Å²	80	110.3 Å²	110.3	56%	0.559	62%	0.623	S	S	*	*	H	α-helix	trans	-54.8	-41.2	176.8	-174.4	0	0	0	0	111.6	D273 F277 Q278 L279	D273-S275 PolarHBondContact O-N 2.87Å; S275-F277 VanDerWaalsContact C-N 3.29Å; S275-F277 PolarHBondContact O-N 3.48Å; S275-Q278 PolarHBondContact O-N 3.01Å; S275-L279 PolarHBondContact O-N 3.45Å
276	G	87.9	Confident	80.8	Confident	49 Å²	49	112.2 Å²	112.2	51%	0.505	62%	0.619	S	S	.	*	H	α-helix	trans	-64.1	-32.4	176.1	0	0	0	0	0	113.8	F274 L280	F274-G276 VanDerWaalsContact C-N 3.25Å; F274-G276 PolarHBondContact O-N 3.46Å; G276-L280 PolarHBondContact O-N 3.21Å
277	F	87.9	Confident	81.7	Confident	139 Å²	139	114.8 Å²	114.8	61%	0.61	61%	0.614	S	S	*	*	H	α-helix	trans	-73.8	-42.6	175.7	-177.6	-100.5	0	0	0	111.2	F274 S275 L279 L280 V281	F274-F277 HydrophobicContact CB-CB 4.49Å; F274-F277 WeakPolarHBondContact O-CB 3.41Å; F274-F277 PolarHBondContact O-N 3.35Å; S275-F277 VanDerWaalsContact C-N 3.29Å; S275-F277 PolarHBondContact O-N 3.48Å; F277-L279 VanDerWaalsContact C-N 3.31Å; F277-L279 PolarHBondContact O-N 3.3Å; F277-L280 WeakPolarHBondContact O-CB 3.49Å; F277-L280 PolarHBondContact O-N 2.97Å; F277-L280 VanDerWaalsContact O-N 3.09Å; F277-V281 HydrophobicContact CD1-CG2 4.08Å; F277-V281 HydrophobicContact CE1-CG2 3.68Å; F277-V281 HydrophobicContact CZ-CG2 3.96Å; F277-V281 WeakPolarHBondContact O-CG2 3.34Å; F277-V281 PolarHBondContact O-N 3.22Å
278	Q	86.6	Confident	82.8	Confident	104 Å²	104	112.6 Å²	112.6	49%	0.486	61%	0.605	S	S	.	*	H	α-helix	trans	-58.3	-44.1	176	-171.4	62	55	0	0	111.6	F274 S275 L280 V281 D282	F274-Q278 PolarHBondContact O-N 3.4Å; S275-Q278 PolarHBondContact O-N 3.01Å; Q278-L280 PolarHBondContact O-N 3.45Å; Q278-V281 PolarHBondContact O-N 3.37Å; Q278-D282 PolarHBondContact NE2-OD1 3.28Å; Q278-D282 VanDerWaalsContact O-CG 3.25Å; Q278-D282 PolarHBondContact O-N 3.41Å
279	L	92.7	Very high	84.2	Confident	116 Å²	116	109.8 Å²	109.8	61%	0.607	59%	0.592	S	S	*	*	H	α-helix	trans	-59.3	-38	176.7	-171.4	69.3	0	0	0	112.1	S275 F277 V283	S275-L279 PolarHBondContact O-N 3.45Å; F277-L279 VanDerWaalsContact C-N 3.31Å; F277-L279 PolarHBondContact O-N 3.3Å; L279-V283 WeakPolarHBondContact O-CB 3.49Å; L279-V283 WeakPolarHBondContact O-CG2 3.23Å; L279-V283 PolarHBondContact O-N 3.15Å
280	L	95	Very high	85.8	Confident	127 Å²	127	109.1 Å²	109.1	67%	0.665	58%	0.584	S	S	*	*	H	α-helix	trans	-68.9	-40.1	178.7	-127	132.5	0	0	0	111.9	G276 F277 Q278 A284	G276-L280 PolarHBondContact O-N 3.21Å; F277-L280 WeakPolarHBondContact O-CB 3.49Å; F277-L280 PolarHBondContact O-N 2.97Å; F277-L280 VanDerWaalsContact O-N 3.09Å; Q278-L280 PolarHBondContact O-N 3.45Å; L280-A284 WeakPolarHBondContact O-CB 3.14Å; L280-A284 PolarHBondContact O-N 3.09Å
281	V	95.5	Very high	87	Confident	49 Å²	49	106.6 Å²	106.6	30%	0.297	57%	0.57	S	S	.	*	H	α-helix	trans	-63.5	-46.1	174.6	172.5	0	0	0	0	110.7	F277 Q278 V283 A284 L285	F277-V281 HydrophobicContact CD1-CG2 4.08Å; F277-V281 HydrophobicContact CE1-CG2 3.68Å; F277-V281 HydrophobicContact CZ-CG2 3.96Å; F277-V281 WeakPolarHBondContact O-CG2 3.34Å; F277-V281 PolarHBondContact O-N 3.22Å; Q278-V281 PolarHBondContact O-N 3.37Å; V281-V283 PolarHBondContact O-N 3.47Å; V281-A284 PolarHBondContact O-N 3.12Å; V281-L285 HydrophobicContact CG1-CD1 4.03Å; V281-L285 WeakPolarHBondContact O-CB 3.36Å; V281-L285 PolarHBondContact O-N 2.9Å
282	D	94.5	Very high	88.4	Confident	83 Å²	83	107.1 Å²	107.1	44%	0.444	57%	0.565	S	S	.	*	H	α-helix	trans	-63.7	-41.7	-179.7	-66	-8.5	0	0	0	111.4	Q278 K286	Q278-D282 PolarHBondContact NE2-OD1 3.28Å; Q278-D282 VanDerWaalsContact O-CG 3.25Å; Q278-D282 PolarHBondContact O-N 3.41Å; D282-K286 WeakPolarHBondContact O-CB 3.19Å; D282-K286 PolarHBondContact O-N 3.09Å
283	V	95.9	Very high	89.4	Confident	91 Å²	91	104.8 Å²	104.8	55%	0.552	56%	0.557	S	S	*	*	H	α-helix	trans	-64.7	-42	175.1	170.3	0	0	0	0	111.3	L279 V281 K286 R287	L279-V283 WeakPolarHBondContact O-CB 3.49Å; L279-V283 WeakPolarHBondContact O-CG2 3.23Å; L279-V283 PolarHBondContact O-N 3.15Å; V281-V283 PolarHBondContact O-N 3.47Å; V283-K286 PolarHBondContact O-N 3.46Å; V283-R287 WeakPolarHBondContact O-CB 3.38Å; V283-R287 PolarHBondContact O-N 3.07Å
284	A	94.5	Very high	89.9	Confident	58 Å²	58	103.3 Å²	103.3	48%	0.479	55%	0.546	S	S	.	.	H	α-helix	trans	-64.4	-45.5	178.5	0	0	0	0	0	111.9	L280 V281 K286 R287 A288	L280-A284 WeakPolarHBondContact O-CB 3.14Å; L280-A284 PolarHBondContact O-N 3.09Å; V281-A284 PolarHBondContact O-N 3.12Å; A284-K286 VanDerWaalsContact C-N 3.34Å; A284-K286 PolarHBondContact O-N 2.66Å; A284-R287 PolarHBondContact O-N 3.45Å; A284-A288 PolarHBondContact O-N 3.29Å
285	L	95.9	Very high	90.1	Very high	116 Å²	116	98.6 Å²	98.6	61%	0.607	54%	0.535	S	S	*	.	H	α-helix	trans	-60.1	-43.8	175.2	-86.6	165.8	0	0	0	111.6	V281 R287 A288 A289	V281-L285 HydrophobicContact CG1-CD1 4.03Å; V281-L285 WeakPolarHBondContact O-CB 3.36Å; V281-L285 PolarHBondContact O-N 2.9Å; L285-R287 VanDerWaalsContact C-N 3.34Å; L285-R287 PolarHBondContact O-N 3Å; L285-A288 PolarHBondContact O-N 3.36Å; L285-A289 PolarHBondContact O-N 3.37Å
286	K	94.6	Very high	90	Very high	163 Å²	163	101 Å²	101	71%	0.709	54%	0.536	S	S	*	.	H	α-helix	trans	-61.8	-42.2	177.8	-171.6	168.6	-176.3	170.7	0	112	D282 V283 A284 A289 E290	D282-K286 WeakPolarHBondContact O-CB 3.19Å; D282-K286 PolarHBondContact O-N 3.09Å; V283-K286 PolarHBondContact O-N 3.46Å; A284-K286 VanDerWaalsContact C-N 3.34Å; A284-K286 PolarHBondContact O-N 2.66Å; K286-A289 PolarHBondContact O-N 3.4Å; K286-E290 PolarHBondContact O-N 3.02Å; K286-E290 VanDerWaalsContact O-N 3.15Å
287	R	92.6	Very high	89.5	Confident	183 Å²	183	105.1 Å²	105.1	69%	0.691	54%	0.541	S	S	*	.	H	α-helix	trans	-68	-35.8	177.7	-165.7	-179.6	-174.5	-162.9	0.9	112.3	V283 A284 L285 E290 M291	V283-R287 WeakPolarHBondContact O-CB 3.38Å; V283-R287 PolarHBondContact O-N 3.07Å; A284-R287 PolarHBondContact O-N 3.45Å; L285-R287 VanDerWaalsContact C-N 3.34Å; L285-R287 PolarHBondContact O-N 3Å; R287-E290 PolarHBondContact O-N 3.29Å; R287-M291 VanDerWaalsContact O-CG 3.26Å; R287-M291 WeakPolarHBondContact O-CG 3.42Å; R287-M291 PolarHBondContact O-N 2.94Å
288	A	91.4	Very high	88.8	Confident	58 Å²	58	105.6 Å²	105.6	48%	0.479	55%	0.55	S	S	.	.	H	α-helix	trans	-64.6	-43.8	175.9	0	0	0	0	0	111.8	A284 L285 E290 M291 E292	A284-A288 PolarHBondContact O-N 3.29Å; L285-A288 PolarHBondContact O-N 3.36Å; A288-E290 VanDerWaalsContact C-N 3.34Å; A288-E290 PolarHBondContact O-N 3.03Å; A288-M291 PolarHBondContact O-N 3.19Å; A288-E292 PolarHBondContact O-N 2.98Å; A288-E292 VanDerWaalsContact O-N 3.09Å
289	A	92.1	Very high	88.1	Confident	58 Å²	58	107 Å²	107	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-63.7	-38.7	176.6	0	0	0	0	0	112.5	L285 K286 E292 L293	L285-A289 PolarHBondContact O-N 3.37Å; K286-A289 PolarHBondContact O-N 3.4Å; A289-E292 PolarHBondContact O-N 2.9Å; A289-L293 PolarHBondContact O-N 3.15Å; A289-L293 VanDerWaalsContact O-N 3.12Å
290	E	89.6	Confident	86.3	Confident	114 Å²	114	109 Å²	109	53%	0.533	59%	0.589	S	S	.	*	H	α-helix	trans	-65.2	-43.5	176.6	-172.3	178.7	178.9	0	0	112.1	K286 R287 A288 E292 L293 Q294	K286-E290 PolarHBondContact O-N 3.02Å; K286-E290 VanDerWaalsContact O-N 3.15Å; R287-E290 PolarHBondContact O-N 3.29Å; A288-E290 VanDerWaalsContact C-N 3.34Å; A288-E290 PolarHBondContact O-N 3.03Å; E290-E292 VanDerWaalsContact C-N 3.3Å; E290-E292 PolarHBondContact O-N 3.45Å; E290-L293 PolarHBondContact O-N 3.02Å; E290-Q294 WeakPolarHBondContact O-CG 3.21Å; E290-Q294 PolarHBondContact O-N 3.13Å
291	M	84.8	Confident	85.8	Confident	116 Å²	116	108.1 Å²	108.1	57%	0.571	59%	0.585	S	S	*	*	H	α-helix	trans	-59.1	-40.4	174.8	-75.4	-88.6	-51	0	0	112.1	R287 A288 Q294 A295	R287-M291 VanDerWaalsContact O-CG 3.26Å; R287-M291 WeakPolarHBondContact O-CG 3.42Å; R287-M291 PolarHBondContact O-N 2.94Å; A288-M291 PolarHBondContact O-N 3.19Å; M291-Q294 PolarHBondContact O-N 3.3Å; M291-A295 WeakPolarHBondContact O-CB 3.46Å; M291-A295 PolarHBondContact O-N 2.97Å
292	E	86.9	Confident	85.3	Confident	108 Å²	108	111.2 Å²	111.2	51%	0.505	60%	0.6	S	S	.	*	H	α-helix	trans	-66.9	-37.2	177.9	-165.4	-171.7	164.9	0	0	112	A288 A289 E290 A295 K296	A288-E292 PolarHBondContact O-N 2.98Å; A288-E292 VanDerWaalsContact O-N 3.09Å; A289-E292 PolarHBondContact O-N 2.9Å; E290-E292 VanDerWaalsContact C-N 3.3Å; E290-E292 PolarHBondContact O-N 3.45Å; E292-A295 PolarHBondContact O-N 3.29Å; E292-K296 WeakPolarHBondContact O-CG 3.34Å; E292-K296 PolarHBondContact O-N 2.94Å; E292-K296 VanDerWaalsContact OE1-CE 3.23Å; E292-K296 WeakPolarHBondContact OE1-CE 3.49Å; E292-K296 IonicContact OE1-NZ 3.68Å; E292-K296 PolarHBondContact OE1-NZ 2.88Å
293	L	85.3	Confident	84.8	Confident	103 Å²	103	112.8 Å²	112.8	54%	0.539	61%	0.609	S	S	.	*	H	α-helix	trans	-67.8	-43.1	176.8	-159	160.4	0	0	0	111	A289 E290 A295 K296 Q297	A289-L293 PolarHBondContact O-N 3.15Å; A289-L293 VanDerWaalsContact O-N 3.12Å; E290-L293 PolarHBondContact O-N 3.02Å; L293-A295 VanDerWaalsContact C-N 3.32Å; L293-A295 PolarHBondContact O-N 2.93Å; L293-K296 PolarHBondContact O-N 3.32Å; L293-Q297 HydrophobicContact CD2-CG 4.12Å; L293-Q297 WeakPolarHBondContact O-CG 3.35Å; L293-Q297 PolarHBondContact O-N 2.97Å
294	Q	83.3	Confident	84.2	Confident	101 Å²	101	114.1 Å²	114.1	47%	0.472	61%	0.612	S	S	.	*	H	α-helix	trans	-61.3	-40.5	173.7	-70.3	179.5	5	0	0	111.9	E290 M291 K296 Q297 L298	E290-Q294 WeakPolarHBondContact O-CG 3.21Å; E290-Q294 PolarHBondContact O-N 3.13Å; M291-Q294 PolarHBondContact O-N 3.3Å; Q294-K296 PolarHBondContact O-N 3.39Å; Q294-Q297 PolarHBondContact O-N 2.79Å; Q294-L298 PolarHBondContact O-N 3.01Å
295	A	83	Confident	83.5	Confident	54 Å²	54	117.6 Å²	117.6	45%	0.446	62%	0.62	S	S	.	*	H	α-helix	trans	-63.9	-39.2	176.1	0	0	0	0	0	112.4	M291 E292 L293 L298 V299	M291-A295 WeakPolarHBondContact O-CB 3.46Å; M291-A295 PolarHBondContact O-N 2.97Å; E292-A295 PolarHBondContact O-N 3.29Å; L293-A295 VanDerWaalsContact C-N 3.32Å; L293-A295 PolarHBondContact O-N 2.93Å; A295-L298 PolarHBondContact O-N 3.17Å; A295-V299 WeakPolarHBondContact O-CG2 3.46Å
296	K	80.9	Confident	82.7	Confident	132 Å²	132	117.7 Å²	117.7	57%	0.574	62%	0.621	S	S	*	*	H	α-helix	trans	-69.1	-32.2	176.9	-72.4	170.9	-176.8	169.5	0	113	E292 L293 Q294 L298	E292-K296 WeakPolarHBondContact O-CG 3.34Å; E292-K296 PolarHBondContact O-N 2.94Å; E292-K296 VanDerWaalsContact OE1-CE 3.23Å; E292-K296 WeakPolarHBondContact OE1-CE 3.49Å; E292-K296 IonicContact OE1-NZ 3.68Å; E292-K296 PolarHBondContact OE1-NZ 2.88Å; L293-K296 PolarHBondContact O-N 3.32Å; Q294-K296 PolarHBondContact O-N 3.39Å; K296-L298 VanDerWaalsContact C-N 3.34Å
297	Q	75.6	Confident	81.9	Confident	134 Å²	134	114.4 Å²	114.4	63%	0.626	62%	0.615	S	S	*	*	H	α-helix	trans	-71.6	-25.4	175	-72.4	-174.8	18.2	0	0	113.5	L293 Q294	L293-Q297 HydrophobicContact CD2-CG 4.12Å; L293-Q297 WeakPolarHBondContact O-CG 3.35Å; L293-Q297 PolarHBondContact O-N 2.97Å; Q294-Q297 PolarHBondContact O-N 2.79Å
298	L	74.4	Confident	81	Confident	150 Å²	150	109.2 Å²	109.2	79%	0.785	61%	0.609	S	S	*	*	H	α-helix	trans	-82.3	-14.5	178.3	-80.8	162.4	0	0	0	113.8	Q294 A295 K296	Q294-L298 PolarHBondContact O-N 3.01Å; A295-L298 PolarHBondContact O-N 3.17Å; K296-L298 VanDerWaalsContact C-N 3.34Å
299	V	71.3	Confident	80.2	Confident	134 Å²	134	113.4 Å²	113.4	81%	0.812	62%	0.62	S	S	*	*			trans	-104.6	-6	-177.2	-179.6	0	0	0	0	111.9	A295	A295-V299 WeakPolarHBondContact O-CG2 3.46Å
300	S	54.7	Low	79.1	Confident	157 Å²	157	118.5 Å²	118.5	100%	1.098	63%	0.633	S	S	*	*			trans	-103.8	0	174.2	-171.5	0	0	0	0	112

Retrieved 300 of 300 residues in 100.5 ms (Link to these results)

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