A0A096MJ33_RAT Loading...

Platelet derived growth factor D

AlphaFold DB , UniProt , Accession A0A096MJ33, Species RAT (Rattus norvegicus, Rat), Gene Pdgfd, Length 261 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	36.8	Very low	39	Very low	239 Å²	239	156.7 Å²	156.7	100%	1.177	81%	0.806	S	S	*	*				0	125.2	0	-66.8	179	-171.9	0	0	107.9
2	H	36.1	Very low	38.9	Very low	170 Å²	170	154 Å²	154	79%	0.787	81%	0.809	S	S	*	*			trans	29.4	116.4	163.3	-69.2	-48.1	0	0	0	121.5
3	R	40	Very low	39	Very low	219 Å²	219	148.6 Å²	148.6	83%	0.826	80%	0.8	S	S	*	*				66.3	134.5	90.7	-74.9	-165.6	168.3	-153.5	2	111.7
4	L	39.5	Very low	38.8	Very low	127 Å²	127	148.1 Å²	148.1	67%	0.665	80%	0.797	S	S	*	*			cis	177.2	165.4	8.3	-130.7	148.9	0	0	0	106.6
5	I	42.5	Very low	38.5	Very low	143 Å²	143	151.4 Å²	151.4	73%	0.733	80%	0.802	S	S	*	*			trans	93.8	86.4	152	-55.1	145.1	0	0	0	119.9
6	L	40.1	Very low	38.4	Very low	153 Å²	153	149.5 Å²	149.5	80%	0.801	80%	0.803	S	S	*	*				32.1	144.5	102.7	-102.8	162.1	0	0	0	124
7	V	40.1	Very low	37.9	Very low	125 Å²	125	148.5 Å²	148.5	76%	0.758	81%	0.808	S	S	*	*			trans	71.5	143.4	154.6	-109	0	0	0	0	119.3
8	S	35.8	Very low	38	Very low	91 Å²	91	150.8 Å²	150.8	64%	0.636	80%	0.804	S	S	*	*			cis	-174.4	165.5	-6.8	18.8	0	0	0	0	106.8
9	I	40.1	Very low	37.7	Very low	169 Å²	169	154.9 Å²	154.9	87%	0.867	81%	0.808	S	S	*	*			trans	-177.6	139.2	130.8	-88.4	151.6	0	0	0	111.1
10	L	40.6	Very low	37.8	Very low	154 Å²	154	153.3 Å²	153.3	81%	0.806	80%	0.8	S	S	*	*			trans	-72.4	136.3	-171.1	-88.7	78.2	0	0	0	115.8
11	V	37.9	Very low	37.6	Very low	134 Å²	134	152.2 Å²	152.2	81%	0.812	80%	0.8	S	S	*	*				23	116.4	125.9	-170.5	0	0	0	0	119.3
12	C	37.5	Very low	37.7	Very low	124 Å²	124	150.1 Å²	150.1	84%	0.838	79%	0.785	S	S	*	*			trans	-85.2	143.7	153.1	-60.3	0	0	0	0	111
13	A	40.6	Very low	37.9	Very low	84 Å²	84	146.5 Å²	146.5	69%	0.694	78%	0.784	S	S	*	*			trans	-177.9	121.5	137.2	0	0	0	0	0	113.1
14	N	36	Very low	38	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	78%	0.778	S	S	*	*			trans	38.5	126.9	136.7	-55.1	-47.5	0	0	0	120.7
15	F	34.6	Very low	38.1	Very low	197 Å²	197	141.2 Å²	141.2	86%	0.864	78%	0.784	S	S	*	*				178.6	146.8	87.2	-116.4	-89.5	0	0	0	110.5
16	C	35.6	Very low	38.5	Very low	121 Å²	121	143 Å²	143	82%	0.818	79%	0.789	S	S	*	*			trans	-46.2	142.8	177	-73.2	0	0	0	0	114.7
17	C	30.3	Very low	39.2	Very low	132 Å²	132	141.3 Å²	141.3	89%	0.892	79%	0.791	S	S	*	*			trans	-141.1	119.4	139.7	-145.3	0	0	0	0	110.7
18	Y	40	Very low	40.1	Very low	190 Å²	190	137.7 Å²	137.7	75%	0.745	77%	0.774	S	S	*	*			trans	-32.8	127.8	169.4	-167.2	-94.4	0	0	0	114.8
19	R	32.6	Very low	41.5	Very low	229 Å²	229	136.5 Å²	136.5	86%	0.864	77%	0.765	S	S	*	*			trans	-154.3	118.8	154.9	-127.7	175.6	167	-177.6	-4.9	111.1	T21	R19-T21 PolarHBondContact O-N 2.9Å
20	D	39	Very low	42.5	Very low	122 Å²	122	134.1 Å²	134.1	65%	0.652	75%	0.753	S	S	*	*			trans	-43.2	116.5	171.9	-71.4	-59	0	0	0	111.2
21	T	34.6	Very low	43.5	Very low	132 Å²	132	134.5 Å²	134.5	81%	0.81	75%	0.748	S	S	*	*			trans	-109.7	100.6	162.2	-35.4	0	0	0	0	106.1	R19 A23	R19-T21 PolarHBondContact O-N 2.9Å; T21-A23 VanDerWaalsContact C-N 3.32Å; T21-A23 PolarHBondContact O-N 3.37Å
22	F	37.5	Very low	44.4	Very low	194 Å²	194	130.8 Å²	130.8	85%	0.851	73%	0.732	S	S	*	*			trans	-53	104.1	158.8	-86.8	-96.5	0	0	0	106.9	T24	F22-T24 PolarHBondContact O-N 2.61Å
23	A	40.5	Very low	45.5	Very low	94 Å²	94	129.2 Å²	129.2	78%	0.777	71%	0.714	S	S	*	*			trans	-66.9	101.1	171.1	0	0	0	0	0	107.1	T21	T21-A23 VanDerWaalsContact C-N 3.32Å; T21-A23 PolarHBondContact O-N 3.37Å
24	T	43.5	Very low	46.3	Very low	113 Å²	113	133.1 Å²	133.1	69%	0.693	71%	0.711	S	S	*	*			trans	-54.7	128.9	164	45.9	0	0	0	0	108	F22 Q26	F22-T24 PolarHBondContact O-N 2.61Å; T24-Q26 PolarHBondContact O-N 2.69Å
25	P	41.7	Very low	47.2	Very low	123 Å²	123	130.1 Å²	130.1	80%	0.799	70%	0.695	S	S	*	*			trans	-62.1	110.8	174.8	25.1	-30.2	0	0	0	106.9	S27	P25-S27 PolarHBondContact O-N 2.82Å
26	Q	49.7	Very low	48.4	Very low	180 Å²	180	123.1 Å²	123.1	84%	0.841	67%	0.674	S	S	*	*			trans	-61.6	116.5	171.2	-70.9	-144.8	-7.2	0	0	106.8	T24 A28	T24-Q26 PolarHBondContact O-N 2.69Å; Q26-A28 PolarHBondContact O-N 2.79Å
27	S	54.9	Low	49.2	Very low	118 Å²	118	121.7 Å²	121.7	83%	0.825	66%	0.658	S	S	*	*			trans	-59.6	89.1	168.7	177.5	0	0	0	0	107.5	P25 S29	P25-S27 PolarHBondContact O-N 2.82Å; S27-S29 PolarHBondContact O-N 2.86Å; S27-S29 VanDerWaalsContact O-N 3.13Å
28	A	58.8	Low	50.5	Low	49 Å²	49	120.7 Å²	120.7	41%	0.405	64%	0.643	S	S	.	*			trans	-59.9	118.7	166.2	0	0	0	0	0	105.8	Q26 I30 L33	Q26-A28 PolarHBondContact O-N 2.79Å; A28-I30 PolarHBondContact O-N 3.44Å; A28-L33 HydrophobicContact CB-CD1 3.96Å; A28-L33 HydrophobicContact CB-CD2 4.11Å; A28-L33 HydrophobicContact CB-CG 3.8Å
29	S	66.6	Low	51.2	Low	65 Å²	65	120.3 Å²	120.3	46%	0.455	64%	0.64	S	S	.	*			trans	-49	134.2	179.7	-179.1	0	0	0	0	109.2	S27 K31 A32 L33	S27-S29 PolarHBondContact O-N 2.86Å; S27-S29 VanDerWaalsContact O-N 3.13Å; S29-K31 CarbonylContact O-C 3.51Å; S29-K31 PolarHBondContact O-N 2.95Å; S29-K31 PolarHBondContact OG-N 3.33Å; S29-A32 WeakPolarHBondContact O-CA 3.35Å; S29-A32 WeakPolarHBondContact O-CB 3.29Å; S29-A32 PolarHBondContact O-N 3.46Å; S29-L33 PolarHBondContact O-N 2.87Å
30	I	60.6	Low	52.1	Low	120 Å²	120	117.7 Å²	117.7	62%	0.615	63%	0.631	S	S	*	*	H	α-helix	trans	-50.8	-29	175	-64.8	174.5	0	0	0	110.6	A28 R34	A28-I30 PolarHBondContact O-N 3.44Å; I30-R34 HydrophobicContact CG2-CG 4.46Å; I30-R34 WeakPolarHBondContact O-CB 3.38Å; I30-R34 VanDerWaalsContact O-CG 3.27Å; I30-R34 WeakPolarHBondContact O-CG 3.34Å; I30-R34 PolarHBondContact O-N 3.42Å
31	K	60.7	Low	52.8	Low	161 Å²	161	117.3 Å²	117.3	70%	0.7	63%	0.628	S	S	*	*	H	α-helix	trans	-69.2	-39.4	173.3	-66.1	-177.3	178.3	-179.8	0	113.4	S29 N35	S29-K31 CarbonylContact O-C 3.51Å; S29-K31 PolarHBondContact O-N 2.95Å; S29-K31 PolarHBondContact OG-N 3.33Å; K31-N35 WeakPolarHBondContact O-CB 3.22Å; K31-N35 VanDerWaalsContact O-CG 3.3Å; K31-N35 PolarHBondContact O-N 3.18Å; K31-N35 PolarHBondContact O-OD1 3.43Å
32	A	57.8	Low	53.7	Low	57 Å²	57	119.3 Å²	119.3	47%	0.471	63%	0.628	S	S	.	*	H	α-helix	trans	-71.4	-40.4	176.9	0	0	0	0	0	111.7	S29 N35 A36	S29-A32 WeakPolarHBondContact O-CA 3.35Å; S29-A32 WeakPolarHBondContact O-CB 3.29Å; S29-A32 PolarHBondContact O-N 3.46Å; A32-N35 PolarHBondContact O-N 2.93Å; A32-A36 WeakPolarHBondContact O-CB 3.38Å; A32-A36 PolarHBondContact O-N 2.95Å
33	L	60	Low	54.6	Low	90 Å²	90	114.2 Å²	114.2	47%	0.471	62%	0.617	S	S	.	*	H	α-helix	trans	-66.1	-42	172.4	-71.7	169	0	0	0	111.7	A28 S29 N35 A36 N37	A28-L33 HydrophobicContact CB-CD1 3.96Å; A28-L33 HydrophobicContact CB-CD2 4.11Å; A28-L33 HydrophobicContact CB-CG 3.8Å; S29-L33 PolarHBondContact O-N 2.87Å; L33-N35 PolarHBondContact O-N 2.76Å; L33-A36 PolarHBondContact O-N 3.27Å; L33-N37 WeakPolarHBondContact O-CB 3.42Å; L33-N37 VanDerWaalsContact O-CG 3.24Å; L33-N37 PolarHBondContact O-N 2.99Å; L33-N37 PolarHBondContact O-ND2 3.26Å
34	R	57.4	Low	55.2	Low	167 Å²	167	114.1 Å²	114.1	63%	0.63	60%	0.604	S	S	*	*	H	α-helix	trans	-59.8	-43.7	172	-85.3	-179.5	176.7	170.5	-0.2	112.1	I30 N37 L38	I30-R34 HydrophobicContact CG2-CG 4.46Å; I30-R34 WeakPolarHBondContact O-CB 3.38Å; I30-R34 VanDerWaalsContact O-CG 3.27Å; I30-R34 WeakPolarHBondContact O-CG 3.34Å; I30-R34 PolarHBondContact O-N 3.42Å; R34-N37 PolarHBondContact O-N 3.13Å; R34-L38 WeakPolarHBondContact O-CB 3.36Å; R34-L38 VanDerWaalsContact O-CG 3.24Å; R34-L38 WeakPolarHBondContact O-CG 3.38Å; R34-L38 PolarHBondContact O-N 2.86Å
35	N	55.3	Low	55.8	Low	78 Å²	78	115.6 Å²	115.6	42%	0.417	60%	0.602	S	S	.	*	H	α-helix	trans	-69.6	-31.3	178.1	-77.2	8.2	0	0	0	113	K31 A32 L33 R39	K31-N35 WeakPolarHBondContact O-CB 3.22Å; K31-N35 VanDerWaalsContact O-CG 3.3Å; K31-N35 PolarHBondContact O-N 3.18Å; K31-N35 PolarHBondContact O-OD1 3.43Å; A32-N35 PolarHBondContact O-N 2.93Å; L33-N35 PolarHBondContact O-N 2.76Å; N35-R39 WeakPolarHBondContact O-CB 3.42Å; N35-R39 VanDerWaalsContact O-CG 3.28Å; N35-R39 WeakPolarHBondContact O-CG 3.4Å; N35-R39 PolarHBondContact O-N 3.01Å; N35-R39 VanDerWaalsContact O-N 3.1Å
36	A	58.7	Low	56.5	Low	50 Å²	50	116.4 Å²	116.4	41%	0.413	60%	0.599	S	S	.	*	H	α-helix	trans	-72.2	-34.7	172.8	0	0	0	0	0	112.1	A32 L33 R40	A32-A36 WeakPolarHBondContact O-CB 3.38Å; A32-A36 PolarHBondContact O-N 2.95Å; L33-A36 PolarHBondContact O-N 3.27Å; A36-R40 WeakPolarHBondContact O-CB 3.48Å; A36-R40 PolarHBondContact O-N 2.94Å
37	N	53.5	Low	57.1	Low	91 Å²	91	112.6 Å²	112.6	49%	0.487	59%	0.588	S	S	.	*	H	α-helix	trans	-71.3	-41.6	173.5	-70.6	-29.4	0	0	0	111.7	L33 R34 R39 R40 D41	L33-N37 WeakPolarHBondContact O-CB 3.42Å; L33-N37 VanDerWaalsContact O-CG 3.24Å; L33-N37 PolarHBondContact O-N 2.99Å; L33-N37 PolarHBondContact O-ND2 3.26Å; R34-N37 PolarHBondContact O-N 3.13Å; N37-R39 VanDerWaalsContact C-N 3.33Å; N37-R39 PolarHBondContact O-N 2.81Å; N37-R40 PolarHBondContact O-N 3.07Å; N37-R40 VanDerWaalsContact O-N 3.16Å; N37-D41 PolarHBondContact O-N 2.88Å; N37-D41 VanDerWaalsContact O-N 3.14Å
38	L	56.3	Low	58.4	Low	112 Å²	112	111.1 Å²	111.1	59%	0.586	57%	0.571	S	S	*	*	H	α-helix	trans	-63	-37.2	174.8	-75	165	0	0	0	112.4	R34 R40 D41	R34-L38 WeakPolarHBondContact O-CB 3.36Å; R34-L38 VanDerWaalsContact O-CG 3.24Å; R34-L38 WeakPolarHBondContact O-CG 3.38Å; R34-L38 PolarHBondContact O-N 2.86Å; L38-R40 VanDerWaalsContact C-N 3.32Å; L38-D41 PolarHBondContact O-N 2.85Å
39	R	54.7	Low	59.9	Low	182 Å²	182	111.9 Å²	111.9	69%	0.687	57%	0.568	S	S	*	*	H	α-helix	trans	-75.2	-19.3	175.7	-74	-178	179.9	121.5	-1.5	113.9	N35 N37	N35-R39 WeakPolarHBondContact O-CB 3.42Å; N35-R39 VanDerWaalsContact O-CG 3.28Å; N35-R39 WeakPolarHBondContact O-CG 3.4Å; N35-R39 PolarHBondContact O-N 3.01Å; N35-R39 VanDerWaalsContact O-N 3.1Å; N37-R39 VanDerWaalsContact C-N 3.33Å; N37-R39 PolarHBondContact O-N 2.81Å
40	R	52.5	Low	61.3	Low	174 Å²	174	114 Å²	114	66%	0.657	57%	0.567	S	S	*	*	H	α-helix	trans	-83	-26.7	174.7	-170.6	179	-71	175.5	-3	111.8	A36 N37 L38 S43	A36-R40 WeakPolarHBondContact O-CB 3.48Å; A36-R40 PolarHBondContact O-N 2.94Å; N37-R40 PolarHBondContact O-N 3.07Å; N37-R40 VanDerWaalsContact O-N 3.16Å; L38-R40 VanDerWaalsContact C-N 3.32Å; R40-S43 PolarHBondContact O-OG 2.81Å
41	D	53.2	Low	63	Low	113 Å²	113	116.5 Å²	116.5	60%	0.604	57%	0.568	S	S	*	*	H	α-helix	trans	-70.3	-35.2	178	-109.5	-7.7	0	0	0	113.2	N37 L38 S43 N44	N37-D41 PolarHBondContact O-N 2.88Å; N37-D41 VanDerWaalsContact O-N 3.14Å; L38-D41 PolarHBondContact O-N 2.85Å; D41-S43 VanDerWaalsContact C-N 3.25Å; D41-S43 PolarHBondContact O-N 2.93Å; D41-N44 PolarHBondContact O-N 3.33Å
42	E	54.6	Low	64.7	Low	174 Å²	174	114.4 Å²	114.4	81%	0.813	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-22	-177.2	-116.5	-170.8	147	0	0	113.8
43	S	54.9	Low	66.6	Low	87 Å²	87	115.8 Å²	115.8	61%	0.608	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-9.9	-179.6	44.9	0	0	0	0	115.1	R40 D41	R40-S43 PolarHBondContact O-OG 2.81Å; D41-S43 VanDerWaalsContact C-N 3.25Å; D41-S43 PolarHBondContact O-N 2.93Å
44	N	53.5	Low	68.4	Low	93 Å²	93	114.5 Å²	114.5	50%	0.497	55%	0.547	S	S	.	.	S	Bend	trans	-108.6	1.5	-177	-87.3	-5.5	0	0	0	114.4	D41 L46 T47	D41-N44 PolarHBondContact O-N 3.33Å; N44-L46 PolarHBondContact O-N 3.08Å; N44-T47 PolarHBondContact O-N 2.78Å; N44-T47 VanDerWaalsContact O-N 3.12Å; N44-T47 PolarHBondContact O-OG1 3.13Å
45	H	57.1	Low	70.3	Confident	143 Å²	143	111.9 Å²	111.9	66%	0.662	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.2	-171.5	-143.3	-29.3	0	0	0	114.5	T47 D48	H45-T47 VanDerWaalsContact C-N 3.32Å; H45-D48 IonicContact CE1-OD2 2.67Å; H45-D48 IonicContact CG-OD2 3.45Å; H45-D48 IonicContact ND1-OD2 3.44Å; H45-D48 PolarHBondContact ND1-OD2 2.63Å
46	L	55	Low	72.4	Confident	141 Å²	141	109.5 Å²	109.5	74%	0.738	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-12	175	-94.2	130.8	0	0	0	114.1	N44	N44-L46 PolarHBondContact O-N 3.08Å
47	T	63.3	Low	74.3	Confident	99 Å²	99	117.6 Å²	117.6	61%	0.607	55%	0.553	S	S	*	*	S	Bend	trans	-117.5	5.8	-176.9	51.6	0	0	0	0	114.3	N44 H45 L49	N44-T47 PolarHBondContact O-N 2.78Å; N44-T47 VanDerWaalsContact O-N 3.12Å; N44-T47 PolarHBondContact O-OG1 3.13Å; H45-T47 VanDerWaalsContact C-N 3.32Å; T47-L49 PolarHBondContact O-N 2.93Å; T47-L49 VanDerWaalsContact O-N 3.16Å
48	D	81.4	Confident	76.4	Confident	88 Å²	88	113.5 Å²	113.5	47%	0.471	53%	0.531	S	S	.	.			trans	-77.3	109	-175.1	-71.2	-22.2	0	0	0	111.5	H45 Y50	H45-D48 IonicContact CE1-OD2 2.67Å; H45-D48 IonicContact CG-OD2 3.45Å; H45-D48 IonicContact ND1-OD2 3.44Å; H45-D48 PolarHBondContact ND1-OD2 2.63Å; D48-Y50 PolarHBondContact O-N 2.84Å
49	L	91.1	Very high	78.3	Confident	65 Å²	65	114.2 Å²	114.2	34%	0.34	54%	0.54	S	S	.	.			trans	-59.2	115.2	169.9	176.5	62.3	0	0	0	110.2	T47 R51 N76 L78	T47-L49 PolarHBondContact O-N 2.93Å; T47-L49 VanDerWaalsContact O-N 3.16Å; L49-R51 HydrophobicContact CD2-CG 4.26Å; L49-R51 HydrophobicContact CG-CG 4.01Å; L49-R51 PolarHBondContact O-N 3.21Å; L49-N76 VanDerWaalsContact CD1-C 3.48Å; L49-N76 WeakPolarHBondContact CD1-O 3.4Å; L49-L78 HydrophobicContact CD1-CB 4.05Å; L49-L78 HydrophobicContact CD2-CB 4.29Å; L49-L78 HydrophobicContact CD2-CD2 4.44Å; L49-L78 HydrophobicContact CG-CB 4.32Å
50	Y	95	Very high	80.3	Confident	108 Å²	108	106.9 Å²	106.9	42%	0.424	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	116.2	173.6	178.2	-96.4	0	0	0	110	D48 R52 N76 L77 L78 L79	D48-Y50 PolarHBondContact O-N 2.84Å; Y50-R52 HydrophobicContact CE1-CB 4.08Å; Y50-R52 PolarHBondContact OH-NE 3.47Å; Y50-R52 PolarHBondContact OH-NH2 3.01Å; Y50-R52 VanDerWaalsContact OH-NH2 3.08Å; Y50-N76 PolarHBondContact N-O 2.79Å; Y50-L77 HydrophobicContact CD1-CD2 3.67Å; Y50-L77 HydrophobicContact CG-CD2 4.22Å; Y50-L77 CarbonylContact O-C 3.59Å; Y50-L78 PolarHBondContact O-N 3Å; Y50-L79 HydrophobicContact CD1-CD2 3.75Å; Y50-L79 HydrophobicContact CE1-CD2 3.66Å
51	R	97	Very high	82.5	Confident	173 Å²	173	104.7 Å²	104.7	65%	0.653	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.6	179.2	-54.7	-168.4	-179.1	-154.9	0.7	111.4	L49 L78	L49-R51 HydrophobicContact CD2-CG 4.26Å; L49-R51 HydrophobicContact CG-CG 4.01Å; L49-R51 PolarHBondContact O-N 3.21Å; R51-L78 VanDerWaalsContact CA-O 3.27Å; R51-L78 WeakPolarHBondContact CA-O 3.38Å; R51-L78 HydrophobicContact CG-CB 4.2Å; R51-L78 HydrophobicContact CG-CD2 4.33Å
52	R	96.2	Very high	84.6	Confident	118 Å²	118	100.2 Å²	100.2	45%	0.445	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	139.2	172.4	-178.7	-176.2	-88	-144.5	7.3	109.9	Y50 E54 L78 L79 T80	Y50-R52 HydrophobicContact CE1-CB 4.08Å; Y50-R52 PolarHBondContact OH-NE 3.47Å; Y50-R52 PolarHBondContact OH-NH2 3.01Å; Y50-R52 VanDerWaalsContact OH-NH2 3.08Å; R52-E54 VanDerWaalsContact CD-OE1 3.26Å; R52-E54 WeakPolarHBondContact CD-OE1 3.42Å; R52-E54 HydrophobicContact CG-CG 4.06Å; R52-E54 IonicContact CZ-OE1 3.65Å; R52-E54 IonicContact NE-OE1 3.38Å; R52-E54 IonicContact NH1-OE1 2.78Å; R52-E54 PolarHBondContact NH1-OE1 2.58Å; R52-L78 PolarHBondContact N-O 2.81Å; R52-L79 HydrophobicContact CB-CD2 3.67Å; R52-L79 CarbonylContact O-C 3.57Å; R52-L79 WeakPolarHBondContact O-CA 3.41Å; R52-T80 PolarHBondContact O-N 3.14Å
53	D	98	Very high	86.7	Confident	85 Å²	85	96.4 Å²	96.4	46%	0.455	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	117.2	179.5	-165.8	-37.1	0	0	0	108.7	T80 R82	D53-T80 WeakPolarHBondContact CA-O 3.45Å; D53-R82 IonicContact OD1-CZ 2.61Å; D53-R82 IonicContact OD1-NH1 2.66Å; D53-R82 PolarHBondContact OD1-NH1 3.41Å; D53-R82 IonicContact OD2-CZ 2.71Å; D53-R82 IonicContact OD2-NH1 3.8Å; D53-R82 PolarHBondContact OD2-NH1 2.92Å; D53-R82 IonicContact OD2-NH2 3.76Å; D53-R82 PolarHBondContact OD2-NH2 2.86Å
54	E	97.9	Very high	88.8	Confident	63 Å²	63	92.6 Å²	92.6	29%	0.294	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.3	-177.2	-70	-179.8	176.2	0	0	110.5	R52 T80 W81 R82	R52-E54 VanDerWaalsContact CD-OE1 3.26Å; R52-E54 WeakPolarHBondContact CD-OE1 3.42Å; R52-E54 HydrophobicContact CG-CG 4.06Å; R52-E54 IonicContact CZ-OE1 3.65Å; R52-E54 IonicContact NE-OE1 3.38Å; R52-E54 IonicContact NH1-OE1 2.78Å; R52-E54 PolarHBondContact NH1-OE1 2.58Å; E54-T80 PolarHBondContact N-O 3.28Å; E54-W81 CarbonylContact O-C 3.58Å; E54-W81 WeakPolarHBondContact O-CA 3.49Å; E54-W81 PolarHBondContact OE2-NE1 3.08Å; E54-R82 PolarHBondContact O-N 2.82Å
55	N	98.2	Very high	91	Very high	112 Å²	112	91.1 Å²	91.1	60%	0.599	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.6	172.4	-68.1	-89.7	0	0	0	108.7	R82	N55-R82 CarbonylContact C-O 3.57Å; N55-R82 WeakPolarHBondContact CA-O 3.37Å
56	I	98.4	Very high	92.9	Very high	28 Å²	28	84.3 Å²	84.3	14%	0.144	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.9	-174.1	-60.8	178.3	0	0	0	109.1	V58 V64 W81 R82 L83 H84 Y167	I56-V58 HydrophobicContact CG2-CG2 4.45Å; I56-V64 HydrophobicContact CD1-CG1 3.58Å; I56-W81 HydrophobicContact CD1-CB 4.35Å; I56-W81 HydrophobicContact CD1-CG 4.39Å; I56-R82 PolarHBondContact N-O 3.3Å; I56-L83 HydrophobicContact CB-CD1 4.33Å; I56-L83 HydrophobicContact CB-CG 4.15Å; I56-L83 HydrophobicContact CD1-CD1 4.13Å; I56-L83 HydrophobicContact CG2-CG 4.41Å; I56-L83 CarbonylContact O-C 3.54Å; I56-L83 WeakPolarHBondContact O-CA 3.27Å; I56-H84 PolarHBondContact O-N 3.17Å; I56-Y167 HydrophobicContact CD1-CE1 4.48Å; I56-Y167 HydrophobicContact CG2-CE1 4.39Å; I56-Y167 HydrophobicContact CG2-CE2 4.36Å
57	R	98.3	Very high	95	Very high	221 Å²	221	79.6 Å²	79.6	83%	0.834	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.8	168.3	-71.7	-173.5	176.2	-158.5	-1.5	109.9	T59 H84	R57-T59 PolarHBondContact O-N 2.66Å; R57-H84 CarbonylContact C-O 3.57Å; R57-H84 WeakPolarHBondContact CA-O 3.21Å
58	V	97.9	Very high	96.6	Very high	5 Å²	5	80.7 Å²	80.7	3%	0.03	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	103.3	179.8	-176.6	0	0	0	0	109	I56 L83 H84 I91 Y167 F169	I56-V58 HydrophobicContact CG2-CG2 4.45Å; V58-L83 HydrophobicContact CG2-CB 3.8Å; V58-L83 HydrophobicContact CG2-CD2 4.06Å; V58-L83 HydrophobicContact CG2-CG 3.99Å; V58-H84 PolarHBondContact N-O 2.67Å; V58-I91 HydrophobicContact CG2-CD1 4.18Å; V58-Y167 HydrophobicContact CB-CD2 4.47Å; V58-Y167 HydrophobicContact CG1-CD2 3.84Å; V58-Y167 HydrophobicContact CG1-CE2 4.19Å; V58-Y167 HydrophobicContact CG2-CD2 3.9Å; V58-Y167 HydrophobicContact CG2-CE2 4.05Å; V58-F169 HydrophobicContact CG1-CB 4.11Å; V58-F169 HydrophobicContact CG1-CD1 4.42Å
59	T	96.8	Very high	97.4	Very high	127 Å²	127	77.2 Å²	77.2	78%	0.779	37%	0.373	S	S	*	.	S	Bend	trans	-115	4.2	177.8	52.8	0	0	0	0	112.7	R57 F169	R57-T59 PolarHBondContact O-N 2.66Å; T59-F169 VanDerWaalsContact C-CE1 3.45Å; T59-F169 WeakPolarHBondContact O-CE1 3.37Å
60	G	96.2	Very high	97.7	Very high	28 Å²	28	77.1 Å²	77.1	29%	0.289	38%	0.376	S	S	.	.	S	Bend	trans	-179.1	-154.6	-175.5	0	0	0	0	0	110.1
61	T	98.1	Very high	97.8	Very high	128 Å²	128	77.3 Å²	77.3	79%	0.785	38%	0.384	S	S	*	.			trans	-83.8	148.4	173.4	57.9	0	0	0	0	111.1	Y167	T61-Y167 CarbonylContact C-O 3.57Å; T61-Y167 VanDerWaalsContact CA-O 3.29Å; T61-Y167 WeakPolarHBondContact CA-O 3.43Å
62	G	98.5	Very high	97.8	Very high	18 Å²	18	70.4 Å²	70.4	19%	0.186	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	-168.8	174.8	0	0	0	0	0	111.2	Y166 Y167	G62-Y166 CarbonylContact O-C 3.54Å; G62-Y166 VanDerWaalsContact O-CA 3.32Å; G62-Y166 WeakPolarHBondContact O-CA 3.41Å; G62-Y167 PolarHBondContact N-O 3.45Å; G62-Y167 PolarHBondContact O-N 3.18Å
63	H	98.8	Very high	97.9	Very high	94 Å²	94	65 Å²	65	44%	0.435	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	157.6	176.3	65.2	-76	0	0	0	112.5	K164 I165 Y166	H63-K164 HydrophobicContact CB-CG 4.3Å; H63-I165 CarbonylContact C-O 3.58Å; H63-I165 WeakPolarHBondContact CA-O 3.32Å; H63-I165 WeakPolarHBondContact CB-O 3.12Å; H63-Y166 HydrophobicContact CB-CD1 3.85Å; H63-Y166 HydrophobicContact CB-CE1 4.25Å; H63-Y166 HydrophobicContact CB-CG 4.43Å
64	V	98.8	Very high	97.8	Very high	7 Å²	7	62.9 Å²	62.9	4%	0.042	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153	164.5	-61.6	0	0	0	0	108.6	I56 W81 I149 K164 I165 Y167	I56-V64 HydrophobicContact CD1-CG1 3.58Å; V64-W81 HydrophobicContact CB-CD2 4.04Å; V64-W81 HydrophobicContact CB-CG 4.22Å; V64-W81 HydrophobicContact CB-CZ2 4.48Å; V64-W81 HydrophobicContact CG1-CB 4.27Å; V64-W81 HydrophobicContact CG1-CD2 4.13Å; V64-W81 HydrophobicContact CG1-CG 3.76Å; V64-W81 HydrophobicContact CG2-CD2 4.34Å; V64-W81 HydrophobicContact CG2-CE3 4.45Å; V64-I149 HydrophobicContact CG2-CD1 3.88Å; V64-K164 CarbonylContact O-C 3.6Å; V64-K164 WeakPolarHBondContact O-CA 3.26Å; V64-I165 HydrophobicContact CG2-CB 3.99Å; V64-I165 HydrophobicContact CG2-CD1 4.44Å; V64-I165 PolarHBondContact N-O 2.82Å; V64-I165 PolarHBondContact O-N 2.98Å; V64-Y167 HydrophobicContact CG1-CD1 4.46Å; V64-Y167 HydrophobicContact CG1-CE1 4.15Å
65	Q	98.6	Very high	97.7	Very high	62 Å²	62	64.9 Å²	64.9	29%	0.29	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	156.2	-179.3	58.4	175.3	57.3	0	0	111.6	F69 F163 K164	Q65-F69 HydrophobicContact CB-CB 4.22Å; Q65-F163 CarbonylContact C-O 3.58Å; Q65-F163 VanDerWaalsContact CA-O 3.23Å; Q65-F163 WeakPolarHBondContact CA-O 3.25Å; Q65-F163 VanDerWaalsContact CB-O 3.27Å; Q65-F163 WeakPolarHBondContact CB-O 3.32Å; Q65-K164 HydrophobicContact CB-CB 3.95Å; Q65-K164 HydrophobicContact CB-CG 4.17Å
66	S	98.4	Very high	97.7	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.			trans	-61.3	150	168.8	57.7	0	0	0	0	110.6	R68 F69 G162 F163	S66-R68 PolarHBondContact O-N 2.88Å; S66-F69 WeakPolarHBondContact O-CB 3.37Å; S66-F69 PolarHBondContact O-N 3.48Å; S66-G162 VanDerWaalsContact OG-CA 3.29Å; S66-G162 WeakPolarHBondContact OG-CA 3.28Å; S66-F163 PolarHBondContact N-O 3.31Å; S66-F163 PolarHBondContact OG-N 2.99Å; S66-F163 PolarHBondContact OG-O 3.16Å
67	P	97.9	Very high	97.6	Very high	42 Å²	42	59.7 Å²	59.7	27%	0.273	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	139.4	176.9	-21.9	32.4	0	0	0	110.9	F69 P74 L77 L79	P67-F69 PolarHBondContact O-N 3.39Å; P67-P74 HydrophobicContact CB-CG 4.2Å; P67-L77 HydrophobicContact CG-CD1 3.97Å; P67-L79 HydrophobicContact CG-CD1 3.81Å
68	R	97.4	Very high	97.6	Very high	122 Å²	122	50.9 Å²	50.9	46%	0.46	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	1.6	179	-51.9	-173.6	-76.5	133.7	-6.6	116.6	S66 N71 S72 Y73 P74	S66-R68 PolarHBondContact O-N 2.88Å; R68-N71 CarbonylContact C-O 3.55Å; R68-N71 HydrophobicContact CB-CB 4.22Å; R68-N71 WeakPolarHBondContact O-CA 3.44Å; R68-N71 WeakPolarHBondContact O-CB 3.21Å; R68-N71 PolarHBondContact O-N 3.3Å; R68-N71 PolarHBondContact O-ND2 2.87Å; R68-S72 PolarHBondContact NE-O 3.18Å; R68-S72 VanDerWaalsContact NE-O 3.1Å; R68-S72 PolarHBondContact NH1-O 2.76Å; R68-S72 PolarHBondContact NH2-O 3.02Å; R68-Y73 PolarHBondContact NH2-O 2.92Å; R68-Y73 VanDerWaalsContact NH2-O 3.07Å; R68-P74 VanDerWaalsContact NH2-N 3.18Å
69	F	97.9	Very high	97.6	Very high	16 Å²	16	50.9 Å²	50.9	7%	0.07	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	132.7	175.6	179.7	-87.5	0	0	0	112	Q65 S66 P67 D96 Q98 P161 F163 K164	Q65-F69 HydrophobicContact CB-CB 4.22Å; S66-F69 WeakPolarHBondContact O-CB 3.37Å; S66-F69 PolarHBondContact O-N 3.48Å; P67-F69 PolarHBondContact O-N 3.39Å; F69-D96 HydrophobicContact CZ-CB 4.27Å; F69-Q98 HydrophobicContact CE2-CB 4.11Å; F69-Q98 HydrophobicContact CZ-CB 3.86Å; F69-P161 WeakPolarHBondContact CD2-O 3.36Å; F69-F163 WeakPolarHBondContact CD2-O 3.06Å; F69-K164 HydrophobicContact CD1-CB 3.93Å; F69-K164 HydrophobicContact CD2-CB 4.46Å; F69-K164 HydrophobicContact CE1-CB 3.64Å; F69-K164 HydrophobicContact CE1-CD 4.17Å; F69-K164 HydrophobicContact CE2-CB 4.21Å; F69-K164 HydrophobicContact CG-CB 4.34Å; F69-K164 HydrophobicContact CZ-CB 3.77Å
70	P	97.4	Very high	97.7	Very high	63 Å²	63	45.7 Å²	45.7	41%	0.409	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.1	10.2	6.1	37.2	-36.9	0	0	0	114.5	P161	P70-P161 CarbonylContact C-O 3.58Å; P70-P161 VanDerWaalsContact O-CA 3.31Å; P70-P161 WeakPolarHBondContact O-CA 3.26Å; P70-P161 WeakPolarHBondContact O-CB 3.43Å
71	N	97.4	Very high	97.9	Very high	111 Å²	111	44.9 Å²	44.9	59%	0.594	24%	0.236	S	C	*	.	S	Bend	trans	-75.8	165.8	170.9	-53.8	-65.4	0	0	0	110.6	R68 Y73	R68-N71 CarbonylContact C-O 3.55Å; R68-N71 HydrophobicContact CB-CB 4.22Å; R68-N71 WeakPolarHBondContact O-CA 3.44Å; R68-N71 WeakPolarHBondContact O-CB 3.21Å; R68-N71 PolarHBondContact O-N 3.3Å; R68-N71 PolarHBondContact O-ND2 2.87Å; N71-Y73 PolarHBondContact O-N 2.93Å
72	S	97.2	Very high	97.9	Very high	28 Å²	28	42.7 Å²	42.7	20%	0.196	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-51.3	139.7	-177.4	-47.1	0	0	0	0	112.7	R68 A159 K160	R68-S72 PolarHBondContact NE-O 3.18Å; R68-S72 VanDerWaalsContact NE-O 3.1Å; R68-S72 PolarHBondContact NH1-O 2.76Å; R68-S72 PolarHBondContact NH2-O 3.02Å; S72-A159 WeakPolarHBondContact OG-CA 3.43Å; S72-K160 VanDerWaalsContact CA-O 3.22Å; S72-K160 WeakPolarHBondContact CA-O 3.34Å
73	Y	97.8	Very high	97.9	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.016	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-79.4	153.9	173.3	51.4	-89.6	0	0	0	111	R68 N71 L101 E102 D112 F151 V158 K160	R68-Y73 PolarHBondContact NH2-O 2.92Å; R68-Y73 VanDerWaalsContact NH2-O 3.07Å; N71-Y73 PolarHBondContact O-N 2.93Å; Y73-L101 HydrophobicContact CD1-CD2 4.06Å; Y73-L101 HydrophobicContact CE1-CD2 3.41Å; Y73-L101 VanDerWaalsContact CE1-CD2 3.41Å; Y73-L101 WeakPolarHBondContact OH-CA 3.27Å; Y73-E102 PolarHBondContact OH-N 3.36Å; Y73-D112 HydrophobicContact CE2-CB 4.47Å; Y73-D112 WeakPolarHBondContact CE2-OD2 3.42Å; Y73-D112 PolarHBondContact OH-OD2 3.35Å; Y73-F151 HydrophobicContact CD1-CZ 4.4Å; Y73-F151 HydrophobicContact CD2-CE1 4.3Å; Y73-F151 AromaticContact CD2-CZ 3.68Å; Y73-F151 HydrophobicContact CD2-CZ 3.68Å; Y73-F151 AromaticContact CE2-CZ 3.99Å; Y73-F151 HydrophobicContact CE2-CZ 3.99Å; Y73-F151 HydrophobicContact CG-CE1 4.37Å; Y73-F151 AromaticContact CG-CZ 3.89Å; Y73-F151 HydrophobicContact CG-CZ 3.89Å; Y73-V158 HydrophobicContact CE1-CG2 4.46Å; Y73-V158 HydrophobicContact CE2-CG2 3.85Å; Y73-V158 WeakPolarHBondContact OH-CG2 3.37Å; Y73-K160 WeakPolarHBondContact CD1-O 3.16Å; Y73-K160 HydrophobicContact CE1-CB 3.65Å
74	P	96.3	Very high	97.8	Very high	42 Å²	42	40.1 Å²	40.1	27%	0.273	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-65.5	154.8	169.7	-19	29.4	0	0	0	112.6	P67 R68 L77 S153	P67-P74 HydrophobicContact CB-CG 4.2Å; R68-P74 VanDerWaalsContact NH2-N 3.18Å; P74-L77 HydrophobicContact CB-CD1 4.19Å; P74-L77 HydrophobicContact CB-CD2 4.27Å; P74-L77 HydrophobicContact CB-CG 4.34Å; P74-L77 HydrophobicContact CG-CD1 4.36Å; P74-L77 WeakPolarHBondContact O-CD1 3.24Å; P74-L77 WeakPolarHBondContact O-CG 3.42Å; P74-S153 PolarHBondContact O-OG 3.11Å
75	R	96.4	Very high	97.7	Very high	105 Å²	105	40.3 Å²	40.3	40%	0.396	20%	0.198	S	C	.	.	S	Bend	trans	-77.9	169.9	167.3	78.7	-168.3	-166.4	-92.7	-8.4	111.2	S153 D154 D155 Y156	R75-S153 VanDerWaalsContact C-OG 3.3Å; R75-S153 WeakPolarHBondContact CA-OG 3.12Å; R75-D154 CarbonylContact C-O 3.58Å; R75-D154 WeakPolarHBondContact CB-O 3.44Å; R75-D155 WeakPolarHBondContact CD-O 3.04Å; R75-D155 PolarHBondContact NE-O 2.72Å; R75-Y156 WeakPolarHBondContact CB-O 3.33Å
76	N	96.3	Very high	97.6	Very high	24 Å²	24	44.7 Å²	44.7	13%	0.128	22%	0.218	C	C	.	.	S	Bend	trans	55.9	54.8	177.8	-72.8	-41.1	0	0	0	112.9	L49 Y50 S153 D154 D155	L49-N76 VanDerWaalsContact CD1-C 3.48Å; L49-N76 WeakPolarHBondContact CD1-O 3.4Å; Y50-N76 PolarHBondContact N-O 2.79Å; N76-S153 PolarHBondContact N-OG 2.99Å; N76-S153 VanDerWaalsContact N-OG 3.1Å; N76-D154 PolarHBondContact N-O 3.36Å; N76-D155 WeakPolarHBondContact OD1-CA 3.4Å; N76-D155 WeakPolarHBondContact OD1-CB 3.3Å; N76-D155 PolarHBondContact OD1-N 2.82Å
77	L	97.3	Very high	97.3	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142.2	177.5	-62	176.9	0	0	0	111.3	Y50 P67 P74 L79 F151 Q152 S153	Y50-L77 HydrophobicContact CD1-CD2 3.67Å; Y50-L77 HydrophobicContact CG-CD2 4.22Å; Y50-L77 CarbonylContact O-C 3.59Å; P67-L77 HydrophobicContact CG-CD1 3.97Å; P74-L77 HydrophobicContact CB-CD1 4.19Å; P74-L77 HydrophobicContact CB-CD2 4.27Å; P74-L77 HydrophobicContact CB-CG 4.34Å; P74-L77 HydrophobicContact CG-CD1 4.36Å; P74-L77 WeakPolarHBondContact O-CD1 3.24Å; P74-L77 WeakPolarHBondContact O-CG 3.42Å; L77-L79 HydrophobicContact CB-CG 4.4Å; L77-F151 HydrophobicContact CB-CD1 4.49Å; L77-F151 HydrophobicContact CB-CE1 4.38Å; L77-F151 HydrophobicContact CD1-CD1 4.24Å; L77-F151 HydrophobicContact CD1-CE1 3.62Å; L77-Q152 VanDerWaalsContact O-CA 3.29Å; L77-Q152 WeakPolarHBondContact O-CA 3.14Å; L77-S153 WeakPolarHBondContact CB-OG 3.3Å; L77-S153 PolarHBondContact N-O 2.79Å; L77-S153 PolarHBondContact N-OG 3.1Å; L77-S153 PolarHBondContact O-N 2.87Å
78	L	98.4	Very high	97	Very high	37 Å²	37	57.6 Å²	57.6	19%	0.194	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	95.2	162	177.7	63.8	0	0	0	108.4	L49 Y50 R51 R52 T150 F151 Q152	L49-L78 HydrophobicContact CD1-CB 4.05Å; L49-L78 HydrophobicContact CD2-CB 4.29Å; L49-L78 HydrophobicContact CD2-CD2 4.44Å; L49-L78 HydrophobicContact CG-CB 4.32Å; Y50-L78 PolarHBondContact O-N 3Å; R51-L78 VanDerWaalsContact CA-O 3.27Å; R51-L78 WeakPolarHBondContact CA-O 3.38Å; R51-L78 HydrophobicContact CG-CB 4.2Å; R51-L78 HydrophobicContact CG-CD2 4.33Å; R52-L78 PolarHBondContact N-O 2.81Å; L78-T150 HydrophobicContact CD1-CG2 3.91Å; L78-F151 WeakPolarHBondContact CA-O 3.43Å; L78-Q152 HydrophobicContact CD1-CB 4.46Å
79	L	98.8	Very high	96.9	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.3	-177.8	-48	-177.9	0	0	0	109.4	Y50 R52 P67 L77 W81 T150 F151	Y50-L79 HydrophobicContact CD1-CD2 3.75Å; Y50-L79 HydrophobicContact CE1-CD2 3.66Å; R52-L79 HydrophobicContact CB-CD2 3.67Å; R52-L79 CarbonylContact O-C 3.57Å; R52-L79 WeakPolarHBondContact O-CA 3.41Å; P67-L79 HydrophobicContact CG-CD1 3.81Å; L77-L79 HydrophobicContact CB-CG 4.4Å; L79-W81 HydrophobicContact CB-CH2 3.61Å; L79-W81 HydrophobicContact CB-CZ2 4.03Å; L79-W81 HydrophobicContact CB-CZ3 3.9Å; L79-W81 HydrophobicContact CD1-CH2 3.75Å; L79-W81 HydrophobicContact CD1-CZ2 4.05Å; L79-W81 HydrophobicContact CG-CH2 4.33Å; L79-T150 CarbonylContact O-C 3.48Å; L79-T150 WeakPolarHBondContact O-CA 3.19Å; L79-F151 HydrophobicContact CB-CB 4.42Å; L79-F151 HydrophobicContact CD1-CD1 4.09Å; L79-F151 HydrophobicContact CG-CD1 4.4Å; L79-F151 PolarHBondContact N-O 3.02Å; L79-F151 PolarHBondContact O-N 3.24Å
80	T	98.8	Very high	96.8	Very high	18 Å²	18	55.1 Å²	55.1	11%	0.11	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.8	178.6	-51.7	0	0	0	0	109.8	R52 D53 E54 R82 K148 I149	R52-T80 PolarHBondContact O-N 3.14Å; D53-T80 WeakPolarHBondContact CA-O 3.45Å; E54-T80 PolarHBondContact N-O 3.28Å; T80-R82 HydrophobicContact CG2-CG 4.5Å; T80-R82 VanDerWaalsContact CG2-NH1 3.28Å; T80-K148 HydrophobicContact CG2-CD 3.92Å; T80-K148 HydrophobicContact CG2-CG 3.75Å; T80-I149 CarbonylContact C-O 3.56Å; T80-I149 WeakPolarHBondContact CA-O 3.36Å
81	W	98.8	Very high	96.8	Very high	12 Å²	12	52.1 Å²	52.1	5%	0.045	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.1	170.5	-59.3	-85	0	0	0	109.6	E54 I56 V64 L79 L83 K148 I149 F151 F163	E54-W81 CarbonylContact O-C 3.58Å; E54-W81 WeakPolarHBondContact O-CA 3.49Å; E54-W81 PolarHBondContact OE2-NE1 3.08Å; I56-W81 HydrophobicContact CD1-CB 4.35Å; I56-W81 HydrophobicContact CD1-CG 4.39Å; V64-W81 HydrophobicContact CB-CD2 4.04Å; V64-W81 HydrophobicContact CB-CG 4.22Å; V64-W81 HydrophobicContact CB-CZ2 4.48Å; V64-W81 HydrophobicContact CG1-CB 4.27Å; V64-W81 HydrophobicContact CG1-CD2 4.13Å; V64-W81 HydrophobicContact CG1-CG 3.76Å; V64-W81 HydrophobicContact CG2-CD2 4.34Å; V64-W81 HydrophobicContact CG2-CE3 4.45Å; L79-W81 HydrophobicContact CB-CH2 3.61Å; L79-W81 HydrophobicContact CB-CZ2 4.03Å; L79-W81 HydrophobicContact CB-CZ3 3.9Å; L79-W81 HydrophobicContact CD1-CH2 3.75Å; L79-W81 HydrophobicContact CD1-CZ2 4.05Å; L79-W81 HydrophobicContact CG-CH2 4.33Å; W81-L83 HydrophobicContact CB-CD1 3.7Å; W81-K148 CarbonylContact O-C 3.58Å; W81-K148 WeakPolarHBondContact O-CA 3.3Å; W81-I149 HydrophobicContact CB-CB 4.44Å; W81-I149 HydrophobicContact CE3-CB 4.2Å; W81-I149 HydrophobicContact CE3-CG2 4.02Å; W81-I149 HydrophobicContact CZ3-CG2 4.44Å; W81-I149 PolarHBondContact N-O 3.01Å; W81-I149 PolarHBondContact O-N 3.46Å; W81-F151 HydrophobicContact CH2-CB 4.4Å; W81-F151 HydrophobicContact CZ3-CB 3.97Å; W81-F163 HydrophobicContact CH2-CE2 4.38Å; W81-F163 AromaticContact CH2-CZ 3.85Å; W81-F163 HydrophobicContact CH2-CZ 3.85Å; W81-F163 HydrophobicContact CZ3-CE2 4.25Å; W81-F163 AromaticContact CZ3-CZ 3.75Å; W81-F163 HydrophobicContact CZ3-CZ 3.75Å
82	R	98.6	Very high	96.8	Very high	81 Å²	81	49.4 Å²	49.4	31%	0.306	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	107.9	172.8	-70.9	178.1	-178.5	73.4	-8.6	109	D53 E54 N55 I56 T80 H84 K148	D53-R82 IonicContact OD1-CZ 2.61Å; D53-R82 IonicContact OD1-NH1 2.66Å; D53-R82 PolarHBondContact OD1-NH1 3.41Å; D53-R82 IonicContact OD2-CZ 2.71Å; D53-R82 IonicContact OD2-NH1 3.8Å; D53-R82 PolarHBondContact OD2-NH1 2.92Å; D53-R82 IonicContact OD2-NH2 3.76Å; D53-R82 PolarHBondContact OD2-NH2 2.86Å; E54-R82 PolarHBondContact O-N 2.82Å; N55-R82 CarbonylContact C-O 3.57Å; N55-R82 WeakPolarHBondContact CA-O 3.37Å; I56-R82 PolarHBondContact N-O 3.3Å; T80-R82 HydrophobicContact CG2-CG 4.5Å; T80-R82 VanDerWaalsContact CG2-NH1 3.28Å; R82-H84 PolarHBondContact O-CD2 2.75Å; R82-K148 HydrophobicContact CG-CB 4.49Å; R82-K148 HydrophobicContact CG-CD 4.49Å; R82-K148 HydrophobicContact CG-CG 4.05Å
83	L	98.6	Very high	96.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130.3	-179.5	-77.1	63.3	0	0	0	108.7	I56 V58 W81 I91 L93 Q146 I147 I149 Y167	I56-L83 HydrophobicContact CB-CD1 4.33Å; I56-L83 HydrophobicContact CB-CG 4.15Å; I56-L83 HydrophobicContact CD1-CD1 4.13Å; I56-L83 HydrophobicContact CG2-CG 4.41Å; I56-L83 CarbonylContact O-C 3.54Å; I56-L83 WeakPolarHBondContact O-CA 3.27Å; V58-L83 HydrophobicContact CG2-CB 3.8Å; V58-L83 HydrophobicContact CG2-CD2 4.06Å; V58-L83 HydrophobicContact CG2-CG 3.99Å; W81-L83 HydrophobicContact CB-CD1 3.7Å; L83-I91 HydrophobicContact CB-CD1 3.86Å; L83-I91 HydrophobicContact CD2-CG2 4.18Å; L83-I91 WeakPolarHBondContact O-CD1 3.47Å; L83-L93 HydrophobicContact CD2-CD2 4.03Å; L83-Q146 WeakPolarHBondContact O-CA 3.41Å; L83-I147 HydrophobicContact CB-CG2 3.86Å; L83-I147 HydrophobicContact CD2-CG2 4.37Å; L83-I147 PolarHBondContact N-O 3Å; L83-I147 PolarHBondContact O-N 2.79Å; L83-I149 HydrophobicContact CD1-CD1 4.26Å; L83-I149 HydrophobicContact CD2-CD1 4.48Å; L83-Y167 HydrophobicContact CD2-CD1 3.68Å; L83-Y167 HydrophobicContact CD2-CD2 4.24Å; L83-Y167 HydrophobicContact CD2-CE1 4.37Å; L83-Y167 HydrophobicContact CD2-CG 3.6Å
84	H	97.4	Very high	96.9	Very high	58 Å²	58	48.6 Å²	48.6	27%	0.269	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.4	178.7	-61	-90.2	0	0	0	109.6	I56 R57 V58 R82 N145 Q146	I56-H84 PolarHBondContact O-N 3.17Å; R57-H84 CarbonylContact C-O 3.57Å; R57-H84 WeakPolarHBondContact CA-O 3.21Å; V58-H84 PolarHBondContact N-O 2.67Å; R82-H84 PolarHBondContact O-CD2 2.75Å; H84-N145 CarbonylContact C-O 3.57Å; H84-N145 WeakPolarHBondContact CA-O 3.2Å; H84-Q146 PolarHBondContact CE1-OE1 3.21Å; H84-Q146 WeakPolarHBondContact ND1-CG 3.34Å; H84-Q146 PolarHBondContact ND1-OE1 3.35Å
85	S	96.8	Very high	97.1	Very high	11 Å²	11	47.4 Å²	47.4	8%	0.077	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	175.4	173.6	62.9	0	0	0	0	111.2	T89 I91 N145	S85-T89 WeakPolarHBondContact CB-OG1 3.27Å; S85-T89 PolarHBondContact OG-OG1 2.71Å; S85-I91 WeakPolarHBondContact OG-CG1 3.43Å; S85-N145 PolarHBondContact N-O 2.84Å; S85-N145 PolarHBondContact O-ND2 2.7Å; S85-N145 WeakPolarHBondContact OG-CA 3.35Å; S85-N145 WeakPolarHBondContact OG-CB 3.27Å; S85-N145 PolarHBondContact OG-O 2.8Å
86	Q	95.8	Very high	97.1	Very high	154 Å²	154	43.5 Å²	43.5	72%	0.72	20%	0.202	S	C	*	.			trans	-60.5	154.5	176.2	-169.1	165.8	16.2	0	0	111.2	T89 N145	Q86-T89 HydrophobicContact CB-CG2 4.32Å; Q86-T89 PolarHBondContact O-N 2.67Å; Q86-T89 PolarHBondContact O-OG1 2.57Å; Q86-N145 WeakPolarHBondContact O-CB 3.27Å
87	E	92.1	Very high	97.2	Very high	151 Å²	151	50 Å²	50	71%	0.706	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	151.4	173	-65.4	-178.3	-172	0	0	111.9	T89	E87-T89 PolarHBondContact O-N 2.9Å
88	K	91.6	Very high	97.2	Very high	163 Å²	163	54.7 Å²	54.7	71%	0.709	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	21	-178.8	-50.6	178.4	-177.5	178.3	0	114.2	F173	K88-F173 HydrophobicContact CB-CE1 4.32Å; K88-F173 HydrophobicContact CD-CE1 4.3Å
89	T	94.8	Very high	97.2	Very high	9 Å²	9	53.5 Å²	53.5	6%	0.055	25%	0.246	C	C	.	.			trans	-119.4	163.9	169.6	71.2	0	0	0	0	110.1	S85 Q86 E87 N145 F169 V170 E171	S85-T89 WeakPolarHBondContact CB-OG1 3.27Å; S85-T89 PolarHBondContact OG-OG1 2.71Å; Q86-T89 HydrophobicContact CB-CG2 4.32Å; Q86-T89 PolarHBondContact O-N 2.67Å; Q86-T89 PolarHBondContact O-OG1 2.57Å; E87-T89 PolarHBondContact O-N 2.9Å; T89-N145 WeakPolarHBondContact O-CA 3.38Å; T89-N145 WeakPolarHBondContact O-CB 3.39Å; T89-N145 PolarHBondContact O-N 3.35Å; T89-F169 HydrophobicContact CG2-CD2 4.11Å; T89-V170 WeakPolarHBondContact CA-O 3.43Å; T89-V170 WeakPolarHBondContact CB-O 3.4Å; T89-E171 HydrophobicContact CG2-CG 4.18Å
90	R	95.7	Very high	97.2	Very high	77 Å²	77	53.3 Å²	53.3	29%	0.291	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	161	172	-63.2	166.7	70.6	-172	4.4	109.3	T141 S142 F169 V170 D172	R90-T141 HydrophobicContact CB-CG2 3.99Å; R90-S142 PolarHBondContact NE-O 2.84Å; R90-S142 PolarHBondContact NH2-O 2.82Å; R90-F169 CarbonylContact O-C 3.59Å; R90-F169 WeakPolarHBondContact O-CA 3.34Å; R90-V170 HydrophobicContact CB-CG2 3.97Å; R90-V170 PolarHBondContact N-O 3.13Å; R90-V170 PolarHBondContact O-N 2.85Å; R90-D172 WeakPolarHBondContact CD-OD2 3.23Å; R90-D172 IonicContact CZ-OD2 3.83Å; R90-D172 IonicContact NE-OD2 3.22Å; R90-D172 IonicContact NH1-OD2 2.71Å; R90-D172 PolarHBondContact NH1-OD2 2.9Å
91	I	97.9	Very high	97.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.9	-177.2	-57.7	173.7	0	0	0	107.8	V58 L83 S85 L93 T141 S142 I147 S168	V58-I91 HydrophobicContact CG2-CD1 4.18Å; L83-I91 HydrophobicContact CB-CD1 3.86Å; L83-I91 HydrophobicContact CD2-CG2 4.18Å; L83-I91 WeakPolarHBondContact O-CD1 3.47Å; S85-I91 WeakPolarHBondContact OG-CG1 3.43Å; I91-L93 HydrophobicContact CG2-CD2 3.92Å; I91-T141 WeakPolarHBondContact O-CA 3.34Å; I91-S142 PolarHBondContact N-OG 3.3Å; I91-S142 PolarHBondContact O-N 2.84Å; I91-S142 PolarHBondContact O-OG 2.86Å; I91-I147 HydrophobicContact CB-CG2 4.03Å; I91-I147 HydrophobicContact CD1-CG2 3.91Å; I91-I147 HydrophobicContact CG2-CG2 3.83Å; I91-S168 CarbonylContact C-O 3.59Å; I91-S168 WeakPolarHBondContact CA-O 3.1Å
92	Q	98.2	Very high	97.1	Very high	54 Å²	54	53.5 Å²	53.5	25%	0.252	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.9	172.1	-173.7	176.6	98.6	0	0	109.5	I140 Y167 S168 V170	Q92-I140 CarbonylContact C-O 3.6Å; Q92-I140 WeakPolarHBondContact CA-O 3.44Å; Q92-Y167 CarbonylContact O-C 3.59Å; Q92-Y167 VanDerWaalsContact O-CA 3.25Å; Q92-Y167 WeakPolarHBondContact O-CA 3.14Å; Q92-S168 PolarHBondContact N-O 3.38Å; Q92-S168 PolarHBondContact O-N 3.28Å; Q92-V170 HydrophobicContact CB-CG1 4.41Å
93	L	98.8	Very high	97.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.9	174.5	-54.3	-177.1	0	0	0	110.2	L83 I91 V116 R139 I140 I147 I149 I165 Y166	L83-L93 HydrophobicContact CD2-CD2 4.03Å; I91-L93 HydrophobicContact CG2-CD2 3.92Å; L93-V116 HydrophobicContact CD1-CG1 3.79Å; L93-V116 HydrophobicContact CD1-CG2 4.21Å; L93-R139 WeakPolarHBondContact O-CA 3.38Å; L93-I140 HydrophobicContact CB-CB 4.33Å; L93-I140 PolarHBondContact N-O 2.75Å; L93-I140 PolarHBondContact O-N 3Å; L93-I147 HydrophobicContact CD1-CD1 3.66Å; L93-I147 HydrophobicContact CD1-CG1 4.32Å; L93-I147 HydrophobicContact CD1-CG2 4.42Å; L93-I147 HydrophobicContact CD2-CG2 4.5Å; L93-I147 HydrophobicContact CG-CD1 4.24Å; L93-I149 HydrophobicContact CD1-CD1 3.85Å; L93-I149 HydrophobicContact CD1-CG1 4.05Å; L93-I149 HydrophobicContact CD2-CD1 4.17Å; L93-I165 HydrophobicContact CB-CG2 3.91Å; L93-I165 HydrophobicContact CD2-CG2 4.17Å; L93-I165 HydrophobicContact CG-CG2 4.43Å; L93-Y166 CarbonylContact C-O 3.56Å; L93-Y166 WeakPolarHBondContact CA-O 3.37Å
94	A	98.6	Very high	97	Very high	14 Å²	14	55.3 Å²	55.3	12%	0.116	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	125.3	174.8	0	0	0	0	0	110.6	R139 I165 Y166	A94-R139 HydrophobicContact CB-CG 4.14Å; A94-I165 CarbonylContact O-C 3.59Å; A94-I165 WeakPolarHBondContact O-CA 3.41Å; A94-Y166 PolarHBondContact N-O 2.85Å; A94-Y166 PolarHBondContact O-N 3.48Å
95	F	98.6	Very high	97	Very high	17 Å²	17	56.3 Å²	56.3	8%	0.075	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	140.6	178.1	-73.6	-104.6	0	0	0	111.3	F99 V114 V116 W130 I136 P137 I140 I165	F95-F99 AromaticContact CD1-CD2 3.91Å; F95-F99 HydrophobicContact CD1-CD2 3.91Å; F95-F99 HydrophobicContact CD1-CE2 4.28Å; F95-F99 HydrophobicContact CE1-CD2 4.35Å; F95-F99 HydrophobicContact CE1-CE2 4.27Å; F95-V114 HydrophobicContact CE1-CG1 3.8Å; F95-V114 HydrophobicContact CZ-CG1 4.29Å; F95-V116 HydrophobicContact CZ-CG2 4.33Å; F95-W130 HydrophobicContact CZ-CE3 4.28Å; F95-W130 HydrophobicContact CZ-CZ3 4.47Å; F95-I136 HydrophobicContact CB-CG2 3.83Å; F95-P137 HydrophobicContact CB-CB 4.5Å; F95-P137 HydrophobicContact CD1-CB 4.05Å; F95-P137 HydrophobicContact CD1-CG 3.75Å; F95-P137 HydrophobicContact CD2-CB 3.61Å; F95-P137 HydrophobicContact CD2-CG 4.25Å; F95-P137 HydrophobicContact CE1-CB 4.13Å; F95-P137 HydrophobicContact CE1-CG 3.87Å; F95-P137 HydrophobicContact CE2-CB 3.7Å; F95-P137 HydrophobicContact CE2-CG 4.35Å; F95-P137 HydrophobicContact CG-CB 3.79Å; F95-P137 HydrophobicContact CG-CG 3.94Å; F95-P137 HydrophobicContact CZ-CB 3.96Å; F95-P137 HydrophobicContact CZ-CG 4.17Å; F95-I140 HydrophobicContact CE2-CD1 4.2Å; F95-I165 HydrophobicContact CD1-CD1 4.14Å; F95-I165 HydrophobicContact CD1-CG1 3.58Å; F95-I165 HydrophobicContact CD2-CG1 4.32Å; F95-I165 HydrophobicContact CE1-CD1 3.45Å; F95-I165 VanDerWaalsContact CE1-CD1 3.45Å; F95-I165 HydrophobicContact CE1-CG1 3.44Å; F95-I165 VanDerWaalsContact CE1-CG1 3.44Å; F95-I165 HydrophobicContact CE2-CD1 4.33Å; F95-I165 HydrophobicContact CE2-CG1 4.21Å; F95-I165 HydrophobicContact CG-CG1 4.03Å; F95-I165 HydrophobicContact CZ-CD1 3.57Å; F95-I165 HydrophobicContact CZ-CG1 3.79Å
96	D	98.4	Very high	96.9	Very high	24 Å²	24	62 Å²	62	13%	0.128	30%	0.298	C	S	.	.			trans	-68.1	149.6	171.4	-166.5	-74.8	0	0	0	110.8	F69 Q98 F99 K164 Y166	F69-D96 HydrophobicContact CZ-CB 4.27Å; D96-Q98 PolarHBondContact O-N 2.8Å; D96-Q98 PolarHBondContact OD1-N 2.85Å; D96-Q98 VanDerWaalsContact OD1-N 3.09Å; D96-F99 PolarHBondContact O-N 2.84Å; D96-K164 HydrophobicContact CB-CB 3.82Å; D96-K164 HydrophobicContact CB-CG 4.41Å; D96-K164 WeakPolarHBondContact CB-O 3.37Å; D96-K164 PolarHBondContact N-O 2.96Å; D96-Y166 HydrophobicContact CB-CE2 4.05Å; D96-Y166 WeakPolarHBondContact OD2-CE2 3.32Å; D96-Y166 PolarHBondContact OD2-OH 3.04Å; D96-Y166 VanDerWaalsContact OD2-OH 3.11Å
97	H	97.4	Very high	96.8	Very high	159 Å²	159	62.3 Å²	62.3	74%	0.736	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.7	-176.7	-64.6	-71.7	0	0	0	114.1	F99 I136	H97-F99 PolarHBondContact O-N 2.84Å; H97-I136 HydrophobicContact CB-CD1 4.1Å; H97-I136 WeakPolarHBondContact ND1-CD1 2.97Å
98	Q	97.1	Very high	96.9	Very high	106 Å²	106	60.2 Å²	60.2	50%	0.495	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	26.6	176.5	-67.1	176.6	77.6	0	0	113.2	F69 D96 G100 P161	F69-Q98 HydrophobicContact CE2-CB 4.11Å; F69-Q98 HydrophobicContact CZ-CB 3.86Å; D96-Q98 PolarHBondContact O-N 2.8Å; D96-Q98 PolarHBondContact OD1-N 2.85Å; D96-Q98 VanDerWaalsContact OD1-N 3.09Å; Q98-G100 PolarHBondContact O-N 2.87Å; Q98-P161 VanDerWaalsContact O-CG 3.3Å; Q98-P161 WeakPolarHBondContact O-CG 3.2Å
99	F	98.5	Very high	97.2	Very high	11 Å²	11	53.2 Å²	53.2	5%	0.048	27%	0.268	C	S	.	.			trans	-60.2	129	174	179.6	-97.1	0	0	0	111.2	F95 D96 H97 L101 V114 W130 G132 P137 F163	F95-F99 AromaticContact CD1-CD2 3.91Å; F95-F99 HydrophobicContact CD1-CD2 3.91Å; F95-F99 HydrophobicContact CD1-CE2 4.28Å; F95-F99 HydrophobicContact CE1-CD2 4.35Å; F95-F99 HydrophobicContact CE1-CE2 4.27Å; D96-F99 PolarHBondContact O-N 2.84Å; H97-F99 PolarHBondContact O-N 2.84Å; F99-L101 HydrophobicContact CE2-CD1 4.12Å; F99-L101 HydrophobicContact CE2-CG 4.16Å; F99-L101 HydrophobicContact CZ-CD1 3.99Å; F99-L101 HydrophobicContact CZ-CG 4.05Å; F99-V114 HydrophobicContact CE2-CG1 3.7Å; F99-V114 HydrophobicContact CZ-CG1 4.14Å; F99-W130 HydrophobicContact CE1-CB 4.41Å; F99-W130 HydrophobicContact CZ-CB 3.9Å; F99-G132 WeakPolarHBondContact CE1-O 3.29Å; F99-P137 HydrophobicContact CD1-CG 4.21Å; F99-P137 HydrophobicContact CD2-CG 4.23Å; F99-P137 HydrophobicContact CE1-CG 4.06Å; F99-P137 HydrophobicContact CE2-CG 4.11Å; F99-P137 HydrophobicContact CG-CG 4.29Å; F99-P137 HydrophobicContact CZ-CG 4.01Å; F99-F163 HydrophobicContact CD2-CB 3.63Å; F99-F163 HydrophobicContact CE2-CB 3.97Å
100	G	98.4	Very high	97.3	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-168.6	119.2	174.2	0	0	0	0	0	112	Q98 G132 K160 G162	Q98-G100 PolarHBondContact O-N 2.87Å; G100-G132 CarbonylContact C-O 3.58Å; G100-G132 VanDerWaalsContact CA-O 3.3Å; G100-G132 WeakPolarHBondContact CA-O 3.14Å; G100-K160 WeakPolarHBondContact O-CB 3.1Å; G100-G162 PolarHBondContact N-O 2.9Å; G100-G162 VanDerWaalsContact O-CA 3.28Å; G100-G162 WeakPolarHBondContact O-CA 3.45Å; G100-G162 PolarHBondContact O-N 3.12Å
101	L	98.6	Very high	97.3	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.297	C	S	.	.			trans	-121.5	-179.1	171.9	-59.3	-179.2	0	0	0	110.3	Y73 F99 D112 V114 C131 G132 F151 K160 F163	Y73-L101 HydrophobicContact CD1-CD2 4.06Å; Y73-L101 HydrophobicContact CE1-CD2 3.41Å; Y73-L101 VanDerWaalsContact CE1-CD2 3.41Å; Y73-L101 WeakPolarHBondContact OH-CA 3.27Å; F99-L101 HydrophobicContact CE2-CD1 4.12Å; F99-L101 HydrophobicContact CE2-CG 4.16Å; F99-L101 HydrophobicContact CZ-CD1 3.99Å; F99-L101 HydrophobicContact CZ-CG 4.05Å; L101-D112 HydrophobicContact CB-CB 4.35Å; L101-V114 HydrophobicContact CD1-CB 4.39Å; L101-V114 HydrophobicContact CD1-CG1 4.21Å; L101-C131 HydrophobicContact CB-CB 4.36Å; L101-G132 PolarHBondContact N-O 3.35Å; L101-G132 CarbonylContact O-C 3.57Å; L101-G132 WeakPolarHBondContact O-CA 3.38Å; L101-F151 HydrophobicContact CD1-CD2 4.44Å; L101-F151 HydrophobicContact CD1-CE2 4.03Å; L101-F151 HydrophobicContact CD2-CE2 3.7Å; L101-F151 HydrophobicContact CD2-CZ 4.13Å; L101-K160 WeakPolarHBondContact O-CD 3.16Å; L101-F163 HydrophobicContact CD2-CD1 4.4Å
102	E	98.3	Very high	97.4	Very high	35 Å²	35	61.1 Å²	61.1	16%	0.164	30%	0.298	C	S	.	.	S	Bend	trans	-55.4	148	169.9	-172.3	163	-156	0	0	111.5	Y73 Y111 D112 C131 G132 V158	Y73-E102 PolarHBondContact OH-N 3.36Å; E102-Y111 HydrophobicContact CG-CD2 4.33Å; E102-Y111 WeakPolarHBondContact OE2-CB 3.27Å; E102-D112 HydrophobicContact CB-CB 3.88Å; E102-D112 WeakPolarHBondContact CB-OD2 3.47Å; E102-C131 WeakPolarHBondContact O-CB 3.45Å; E102-G132 WeakPolarHBondContact O-CA 3.38Å; E102-G132 PolarHBondContact O-N 3.07Å; E102-V158 HydrophobicContact CB-CG1 4.21Å; E102-V158 HydrophobicContact CB-CG2 4.15Å; E102-V158 HydrophobicContact CG-CG1 4.04Å
103	E	97.7	Very high	97.4	Very high	79 Å²	79	59.2 Å²	59.2	37%	0.369	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-68.1	153.7	-177.8	-58.2	-50.8	140.2	0	0	112.6	G132 H133 K160	E103-G132 VanDerWaalsContact OE2-CA 3.32Å; E103-G132 WeakPolarHBondContact OE2-CA 3.49Å; E103-H133 IonicContact OE1-CE1 3.12Å; E103-H133 PolarHBondContact OE1-CE1 3Å; E103-H133 IonicContact OE1-CG 3.01Å; E103-H133 IonicContact OE1-ND1 2.88Å; E103-H133 PolarHBondContact OE1-ND1 3.47Å; E103-H133 IonicContact OE2-ND1 3.86Å; E103-K160 IonicContact OE1-NZ 2.77Å; E103-K160 PolarHBondContact OE1-NZ 3.31Å
104	A	96.8	Very high	97.4	Very high	39 Å²	39	59.2 Å²	59.2	32%	0.322	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-65.6	146.8	171.3	0	0	0	0	0	111.4	I108	A104-I108 WeakPolarHBondContact CA-O 3.37Å
105	E	96.4	Very high	97.4	Very high	80 Å²	80	59.4 Å²	59.4	37%	0.374	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-101.3	119.8	165.5	-169.6	-171.2	-180	0	0	108.6	D107 I108 Y111	E105-D107 VanDerWaalsContact C-N 3.29Å; E105-D107 PolarHBondContact O-N 2.88Å; E105-I108 PolarHBondContact N-O 3.23Å; E105-I108 WeakPolarHBondContact O-CB 3.39Å; E105-I108 PolarHBondContact O-N 2.86Å; E105-Y111 HydrophobicContact CB-CE2 3.84Å; E105-Y111 PolarHBondContact OE2-OH 3.02Å
106	N	95.1	Very high	97.4	Very high	129 Å²	129	58.6 Å²	58.6	69%	0.69	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	45.5	-177.3	-54.4	-55.7	0	0	0	112.8	I108	N106-I108 PolarHBondContact O-N 2.82Å; N106-I108 VanDerWaalsContact O-N 3.15Å
107	D	93.6	Very high	97.4	Very high	161 Å²	161	58.4 Å²	58.4	86%	0.861	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	15.8	-176.3	-54.8	-47.1	0	0	0	114.9	E105	E105-D107 VanDerWaalsContact C-N 3.29Å; E105-D107 PolarHBondContact O-N 2.88Å
108	I	95.4	Very high	97.4	Very high	107 Å²	107	51.2 Å²	51.2	55%	0.549	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-114.2	125.7	176.9	-59.4	166	0	0	0	109.8	A104 E105 N106 R110	A104-I108 WeakPolarHBondContact CA-O 3.37Å; E105-I108 PolarHBondContact N-O 3.23Å; E105-I108 WeakPolarHBondContact O-CB 3.39Å; E105-I108 PolarHBondContact O-N 2.86Å; N106-I108 PolarHBondContact O-N 2.82Å; N106-I108 VanDerWaalsContact O-N 3.15Å; I108-R110 VanDerWaalsContact C-N 3.27Å; I108-R110 HydrophobicContact CG2-CB 4.5Å; I108-R110 PolarHBondContact O-N 2.89Å
109	C	97	Very high	97.2	Very high	16 Å²	16	47.9 Å²	47.9	11%	0.108	24%	0.236	C	C	.	.			trans	-75.9	78.2	173.4	-60.6	0	0	0	0	111	F113 R129 W130 C131	C109-F113 HydrophobicContact CB-CB 3.89Å; C109-R129 HydrophobicContact CB-CG 4.03Å; C109-W130 VanDerWaalsContact SG-C 3.6Å; C109-C131 WeakPolarHBondContact CA-SG 3.33Å; C109-C131 HydrophobicContact CB-CB 3.54Å; C109-C131 WeakPolarHBondContact CB-SG 3.42Å; C109-C131 WeakPolarHBondContact SG-CB 3.44Å; C109-C131 PolarHBondContact SG-N 2.91Å; C109-C131 CovalentContact SG-SG 2.03Å; C109-C131 PolarHBondContact SG-SG 3.1Å
110	R	96.5	Very high	96.8	Very high	175 Å²	175	49 Å²	49	66%	0.66	25%	0.245	S	C	*	.			trans	-86.8	-36.8	-174.8	-178.2	178.7	172.7	82.7	4.2	113.5	I108	I108-R110 VanDerWaalsContact C-N 3.27Å; I108-R110 HydrophobicContact CG2-CB 4.5Å; I108-R110 PolarHBondContact O-N 2.89Å
111	Y	97.3	Very high	96.1	Very high	75 Å²	75	58.6 Å²	58.6	29%	0.294	29%	0.29	S	S	.	.	S	Bend	trans	-85.7	-82.9	-173.5	-52.9	-64.7	0	0	0	110.5	E102 E105	E102-Y111 HydrophobicContact CG-CD2 4.33Å; E102-Y111 WeakPolarHBondContact OE2-CB 3.27Å; E105-Y111 HydrophobicContact CB-CE2 3.84Å; E105-Y111 PolarHBondContact OE2-OH 3.02Å
112	D	98.4	Very high	95.6	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.016	33%	0.329	C	S	.	.	S	Bend	trans	-103.7	135.1	176.9	-59.5	-22	0	0	0	110.6	Y73 L101 E102 C131 Q152 S153 D154 V158	Y73-D112 HydrophobicContact CE2-CB 4.47Å; Y73-D112 WeakPolarHBondContact CE2-OD2 3.42Å; Y73-D112 PolarHBondContact OH-OD2 3.35Å; L101-D112 HydrophobicContact CB-CB 4.35Å; E102-D112 HydrophobicContact CB-CB 3.88Å; E102-D112 WeakPolarHBondContact CB-OD2 3.47Å; D112-C131 WeakPolarHBondContact O-CB 3.38Å; D112-Q152 WeakPolarHBondContact CA-O 2.77Å; D112-S153 WeakPolarHBondContact OD1-CA 3.35Å; D112-S153 VanDerWaalsContact OD1-CB 3.3Å; D112-S153 WeakPolarHBondContact OD1-CB 3.28Å; D112-D154 PolarHBondContact OD1-N 3.25Å; D112-V158 VanDerWaalsContact OD2-CG2 3.3Å; D112-V158 WeakPolarHBondContact OD2-CG2 3.41Å
113	F	98.7	Very high	95.3	Very high	13 Å²	13	65.2 Å²	65.2	6%	0.057	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	151.6	176.8	61.5	-94.4	0	0	0	112.9	C109 E115 R129 W130 F151 Q152	C109-F113 HydrophobicContact CB-CB 3.89Å; F113-E115 HydrophobicContact CD2-CB 3.96Å; F113-E115 HydrophobicContact CE2-CB 4.13Å; F113-R129 HydrophobicContact CB-CG 3.65Å; F113-R129 HydrophobicContact CD2-CG 3.84Å; F113-R129 HydrophobicContact CG-CG 3.84Å; F113-W130 WeakPolarHBondContact CA-O 3.43Å; F113-F151 WeakPolarHBondContact O-CA 3.43Å; F113-F151 VanDerWaalsContact O-CD2 3.23Å; F113-F151 WeakPolarHBondContact O-CD2 3.41Å; F113-Q152 HydrophobicContact CD1-CB 4.33Å; F113-Q152 HydrophobicContact CE1-CB 3.79Å; F113-Q152 HydrophobicContact CE1-CG 4.17Å; F113-Q152 HydrophobicContact CE2-CB 3.99Å; F113-Q152 HydrophobicContact CZ-CB 3.6Å; F113-Q152 HydrophobicContact CZ-CG 4.24Å; F113-Q152 PolarHBondContact N-O 3.38Å; F113-Q152 PolarHBondContact O-N 3.26Å
114	V	98.8	Very high	95.2	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.1	159	63	0	0	0	0	109	F95 F99 L101 R129 W130 I149 T150 F163 I165	F95-V114 HydrophobicContact CE1-CG1 3.8Å; F95-V114 HydrophobicContact CZ-CG1 4.29Å; F99-V114 HydrophobicContact CE2-CG1 3.7Å; F99-V114 HydrophobicContact CZ-CG1 4.14Å; L101-V114 HydrophobicContact CD1-CB 4.39Å; L101-V114 HydrophobicContact CD1-CG1 4.21Å; V114-R129 WeakPolarHBondContact O-CA 3.39Å; V114-W130 HydrophobicContact CG1-CB 4.29Å; V114-W130 PolarHBondContact N-O 2.85Å; V114-W130 PolarHBondContact O-N 3.04Å; V114-I149 HydrophobicContact CG2-CG2 3.77Å; V114-T150 CarbonylContact C-O 3.54Å; V114-T150 WeakPolarHBondContact CA-O 3.21Å; V114-F163 HydrophobicContact CB-CD1 4.32Å; V114-F163 HydrophobicContact CB-CE1 4.29Å; V114-F163 HydrophobicContact CG2-CE1 4.32Å; V114-F163 HydrophobicContact CG2-CE2 4.43Å; V114-F163 HydrophobicContact CG2-CZ 4.23Å; V114-I165 HydrophobicContact CG2-CD1 4.06Å
115	E	98.8	Very high	95.2	Very high	19 Å²	19	65.7 Å²	65.7	9%	0.089	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.3	-179.8	175.3	161.8	93	0	0	109.6	F113 E117 V126 G128 R129 I149 T150	F113-E115 HydrophobicContact CD2-CB 3.96Å; F113-E115 HydrophobicContact CE2-CB 4.13Å; E115-E117 HydrophobicContact CG-CG 3.98Å; E115-V126 HydrophobicContact CG-CG1 4.15Å; E115-G128 WeakPolarHBondContact CA-O 3.31Å; E115-R129 HydrophobicContact CB-CB 4.45Å; E115-R129 HydrophobicContact CB-CG 4.4Å; E115-R129 IonicContact OE1-NH2 3.74Å; E115-R129 PolarHBondContact OE1-NH2 2.82Å; E115-R129 IonicContact OE2-CZ 2.7Å; E115-R129 IonicContact OE2-NE 3.35Å; E115-R129 PolarHBondContact OE2-NE 3.2Å; E115-R129 IonicContact OE2-NH2 3.61Å; E115-R129 PolarHBondContact OE2-NH2 3.27Å; E115-I149 CarbonylContact O-C 3.58Å; E115-I149 WeakPolarHBondContact O-CA 3.46Å; E115-T150 PolarHBondContact N-O 3.5Å; E115-T150 PolarHBondContact O-N 3.14Å
116	V	98.8	Very high	95.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.4	176.9	177.3	0	0	0	0	108.4	L93 F95 R127 G128 W130 I140 I147 K148 I149	L93-V116 HydrophobicContact CD1-CG1 3.79Å; L93-V116 HydrophobicContact CD1-CG2 4.21Å; F95-V116 HydrophobicContact CZ-CG2 4.33Å; V116-R127 HydrophobicContact CB-CB 4.44Å; V116-R127 HydrophobicContact CG1-CB 4.26Å; V116-R127 HydrophobicContact CG1-CG 4.43Å; V116-R127 WeakPolarHBondContact O-CA 3.36Å; V116-R127 WeakPolarHBondContact O-CB 3.41Å; V116-R127 PolarHBondContact O-N 2.97Å; V116-G128 PolarHBondContact N-O 3.16Å; V116-G128 PolarHBondContact O-N 3.19Å; V116-W130 HydrophobicContact CB-CH2 4.26Å; V116-W130 HydrophobicContact CB-CZ3 3.81Å; V116-W130 HydrophobicContact CG2-CH2 4.44Å; V116-W130 HydrophobicContact CG2-CZ3 3.7Å; V116-I140 HydrophobicContact CB-CD1 3.94Å; V116-I140 HydrophobicContact CG1-CD1 3.91Å; V116-I140 HydrophobicContact CG1-CG2 4.38Å; V116-I140 HydrophobicContact CG2-CD1 3.95Å; V116-I147 HydrophobicContact CG1-CD1 3.49Å; V116-I147 VanDerWaalsContact CG1-CD1 3.49Å; V116-I147 HydrophobicContact CG1-CG1 3.77Å; V116-K148 WeakPolarHBondContact CA-O 3.41Å; V116-I149 HydrophobicContact CG2-CG1 4.34Å
117	E	98.6	Very high	95.4	Very high	20 Å²	20	63.9 Å²	63.9	9%	0.093	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.1	-176.1	-67.4	163.4	82.6	0	0	110	E115 V119 T124 V125 V126 I147 K148	E115-E117 HydrophobicContact CG-CG 3.98Å; E117-V119 HydrophobicContact CB-CG2 4.46Å; E117-T124 HydrophobicContact CB-CG2 3.88Å; E117-T124 HydrophobicContact CG-CG2 4.2Å; E117-T124 VanDerWaalsContact OE1-CG2 3.27Å; E117-T124 WeakPolarHBondContact OE1-CG2 3.22Å; E117-V125 CarbonylContact C-O 3.52Å; E117-V125 WeakPolarHBondContact CA-O 3.28Å; E117-V126 HydrophobicContact CG-CG2 4.07Å; E117-I147 WeakPolarHBondContact O-CG1 3.45Å; E117-K148 HydrophobicContact CB-CB 4.47Å; E117-K148 PolarHBondContact N-O 2.77Å; E117-K148 PolarHBondContact O-N 2.83Å; E117-K148 IonicContact OE1-NZ 3.8Å; E117-K148 PolarHBondContact OE1-NZ 3.35Å; E117-K148 WeakPolarHBondContact OE2-CE 3.3Å; E117-K148 IonicContact OE2-NZ 3.56Å; E117-K148 PolarHBondContact OE2-NZ 3.44Å
118	D	97.1	Very high	95.6	Very high	7 Å²	7	57 Å²	57	4%	0.037	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	124.3	164.5	-87.2	-44.8	0	0	0	108.1	T124 V125 R127 S142 R143	D118-T124 CarbonylContact O-C 3.49Å; D118-T124 WeakPolarHBondContact O-CA 3.29Å; D118-V125 PolarHBondContact N-O 3.07Å; D118-V125 PolarHBondContact O-N 3.1Å; D118-R127 HydrophobicContact CB-CG 4.35Å; D118-R127 WeakPolarHBondContact OD2-CD 3.15Å; D118-R127 IonicContact OD2-NE 3.51Å; D118-R127 PolarHBondContact OD2-NE 3.09Å; D118-S142 WeakPolarHBondContact OD1-CA 3.43Å; D118-S142 VanDerWaalsContact OD1-CB 3.29Å; D118-S142 WeakPolarHBondContact OD1-CB 3.48Å; D118-R143 HydrophobicContact CB-CB 4.5Å; D118-R143 VanDerWaalsContact CG-N 3.33Å; D118-R143 PolarHBondContact OD1-N 3.31Å; D118-R143 VanDerWaalsContact OD2-CG 3.27Å; D118-R143 WeakPolarHBondContact OD2-CG 3.29Å; D118-R143 PolarHBondContact OD2-N 3.16Å
119	V	93.4	Very high	95.7	Very high	36 Å²	36	57.2 Å²	57.2	22%	0.218	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.4	-178.4	-174.2	0	0	0	0	109.1	E117 T124 T144 K148	E117-V119 HydrophobicContact CB-CG2 4.46Å; V119-T124 HydrophobicContact CG2-CG2 4.28Å; V119-T144 PolarHBondContact O-OG1 2.96Å; V119-K148 HydrophobicContact CG2-CB 3.64Å; V119-K148 HydrophobicContact CG2-CD 4.45Å
120	S	88.3	Confident	95.8	Very high	36 Å²	36	58.7 Å²	58.7	25%	0.252	30%	0.297	S	S	.	.			trans	-132.7	172.9	171.3	64.3	0	0	0	0	109	S122 S123	S120-S122 PolarHBondContact O-N 2.85Å; S120-S123 PolarHBondContact N-O 3.33Å; S120-S123 PolarHBondContact OG-N 3.13Å; S120-S123 PolarHBondContact OG-O 3.43Å; S120-S123 PolarHBondContact OG-OG 3.35Å
121	E	84	Confident	95.9	Very high	200 Å²	200	51.3 Å²	51.3	94%	0.935	27%	0.272	S	S	*	.	S	Bend	trans	-60.2	-31.3	178.4	-65.2	178.8	-175.5	0	0	112.9
122	S	88.4	Confident	95.9	Very high	116 Å²	116	47.9 Å²	47.9	81%	0.811	26%	0.26	S	S	*	.	S	Bend	trans	-110.4	-15.3	-172.8	58.9	0	0	0	0	114.6	S120	S120-S122 PolarHBondContact O-N 2.85Å
123	S	92.6	Very high	95.8	Very high	58 Å²	58	53.2 Å²	53.2	41%	0.406	28%	0.284	S	S	.	.			trans	-151.7	153	-174	71.2	0	0	0	0	113.3	S120	S120-S123 PolarHBondContact N-O 3.33Å; S120-S123 PolarHBondContact OG-N 3.13Å; S120-S123 PolarHBondContact OG-O 3.43Å; S120-S123 PolarHBondContact OG-OG 3.35Å
124	T	95.7	Very high	95.3	Very high	78 Å²	78	61.1 Å²	61.1	48%	0.479	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.4	169.7	-61.3	0	0	0	0	108.5	E117 D118 V119	E117-T124 HydrophobicContact CB-CG2 3.88Å; E117-T124 HydrophobicContact CG-CG2 4.2Å; E117-T124 VanDerWaalsContact OE1-CG2 3.27Å; E117-T124 WeakPolarHBondContact OE1-CG2 3.22Å; D118-T124 CarbonylContact O-C 3.49Å; D118-T124 WeakPolarHBondContact O-CA 3.29Å; V119-T124 HydrophobicContact CG2-CG2 4.28Å
125	V	97.4	Very high	95	Very high	50 Å²	50	67.9 Å²	67.9	30%	0.303	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	119.6	-178.2	179.6	0	0	0	0	109.3	E117 D118 R127	E117-V125 CarbonylContact C-O 3.52Å; E117-V125 WeakPolarHBondContact CA-O 3.28Å; D118-V125 PolarHBondContact N-O 3.07Å; D118-V125 PolarHBondContact O-N 3.1Å; V125-R127 PolarHBondContact O-N 2.9Å
126	V	97.9	Very high	94.9	Very high	75 Å²	75	70.7 Å²	70.7	46%	0.455	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	123.3	174.7	-178.7	0	0	0	0	109.4	E115 E117	E115-V126 HydrophobicContact CG-CG1 4.15Å; E117-V126 HydrophobicContact CG-CG2 4.07Å
127	R	97.6	Very high	94.8	Very high	97 Å²	97	71 Å²	71	37%	0.366	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-30.3	175.5	-55.1	-56.6	-77.8	119.7	8.6	111.8	V116 D118 V125 I140	V116-R127 HydrophobicContact CB-CB 4.44Å; V116-R127 HydrophobicContact CG1-CB 4.26Å; V116-R127 HydrophobicContact CG1-CG 4.43Å; V116-R127 WeakPolarHBondContact O-CA 3.36Å; V116-R127 WeakPolarHBondContact O-CB 3.41Å; V116-R127 PolarHBondContact O-N 2.97Å; D118-R127 HydrophobicContact CB-CG 4.35Å; D118-R127 WeakPolarHBondContact OD2-CD 3.15Å; D118-R127 IonicContact OD2-NE 3.51Å; D118-R127 PolarHBondContact OD2-NE 3.09Å; V125-R127 PolarHBondContact O-N 2.9Å; R127-I140 HydrophobicContact CB-CG2 4.34Å; R127-I140 HydrophobicContact CG-CG2 4.47Å
128	G	97.3	Very high	94.8	Very high	16 Å²	16	74 Å²	74	17%	0.165	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.7	169.5	166.7	0	0	0	0	0	111.3	E115 V116 W130	E115-G128 WeakPolarHBondContact CA-O 3.31Å; V116-G128 PolarHBondContact N-O 3.16Å; V116-G128 PolarHBondContact O-N 3.19Å; G128-W130 VanDerWaalsContact C-CH2 3.49Å; G128-W130 WeakPolarHBondContact O-CZ3 3.23Å
129	R	98	Very high	94.8	Very high	112 Å²	112	82.1 Å²	82.1	42%	0.423	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.1	176.2	-178	-178.7	-65.2	-169.4	-3.6	107.2	C109 F113 V114 E115	C109-R129 HydrophobicContact CB-CG 4.03Å; F113-R129 HydrophobicContact CB-CG 3.65Å; F113-R129 HydrophobicContact CD2-CG 3.84Å; F113-R129 HydrophobicContact CG-CG 3.84Å; V114-R129 WeakPolarHBondContact O-CA 3.39Å; E115-R129 HydrophobicContact CB-CB 4.45Å; E115-R129 HydrophobicContact CB-CG 4.4Å; E115-R129 IonicContact OE1-NH2 3.74Å; E115-R129 PolarHBondContact OE1-NH2 2.82Å; E115-R129 IonicContact OE2-CZ 2.7Å; E115-R129 IonicContact OE2-NE 3.35Å; E115-R129 PolarHBondContact OE2-NE 3.2Å; E115-R129 IonicContact OE2-NH2 3.61Å; E115-R129 PolarHBondContact OE2-NH2 3.27Å
130	W	98.4	Very high	95.1	Very high	46 Å²	46	80.9 Å²	80.9	17%	0.174	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.1	-172.5	-58.2	-87.6	0	0	0	112	F95 F99 C109 F113 V114 V116 G128 P137 P138 I140	F95-W130 HydrophobicContact CZ-CE3 4.28Å; F95-W130 HydrophobicContact CZ-CZ3 4.47Å; F99-W130 HydrophobicContact CE1-CB 4.41Å; F99-W130 HydrophobicContact CZ-CB 3.9Å; C109-W130 VanDerWaalsContact SG-C 3.6Å; F113-W130 WeakPolarHBondContact CA-O 3.43Å; V114-W130 HydrophobicContact CG1-CB 4.29Å; V114-W130 PolarHBondContact N-O 2.85Å; V114-W130 PolarHBondContact O-N 3.04Å; V116-W130 HydrophobicContact CB-CH2 4.26Å; V116-W130 HydrophobicContact CB-CZ3 3.81Å; V116-W130 HydrophobicContact CG2-CH2 4.44Å; V116-W130 HydrophobicContact CG2-CZ3 3.7Å; G128-W130 VanDerWaalsContact C-CH2 3.49Å; G128-W130 WeakPolarHBondContact O-CZ3 3.23Å; W130-P137 HydrophobicContact CB-CB 4.41Å; W130-P137 HydrophobicContact CB-CG 3.66Å; W130-P137 HydrophobicContact CD2-CB 3.75Å; W130-P137 HydrophobicContact CD2-CG 3.99Å; W130-P137 HydrophobicContact CE3-CB 4.39Å; W130-P137 HydrophobicContact CG-CB 3.73Å; W130-P137 HydrophobicContact CG-CG 3.51Å; W130-P138 HydrophobicContact CZ2-CG 4.47Å; W130-I140 HydrophobicContact CH2-CD1 3.36Å; W130-I140 HydrophobicContact CH2-CG1 4.42Å; W130-I140 HydrophobicContact CZ2-CD1 4.11Å; W130-I140 HydrophobicContact CZ3-CD1 3.93Å
131	C	98.4	Very high	95.5	Very high	20 Å²	20	81.1 Å²	81.1	14%	0.135	41%	0.411	C	S	.	.			trans	-155.4	-175.7	177.9	64.6	0	0	0	0	109.5	L101 E102 C109 D112	L101-C131 HydrophobicContact CB-CB 4.36Å; E102-C131 WeakPolarHBondContact O-CB 3.45Å; C109-C131 WeakPolarHBondContact CA-SG 3.33Å; C109-C131 HydrophobicContact CB-CB 3.54Å; C109-C131 WeakPolarHBondContact CB-SG 3.42Å; C109-C131 WeakPolarHBondContact SG-CB 3.44Å; C109-C131 PolarHBondContact SG-N 2.91Å; C109-C131 CovalentContact SG-SG 2.03Å; C109-C131 PolarHBondContact SG-SG 3.1Å; D112-C131 WeakPolarHBondContact O-CB 3.38Å
132	G	97.7	Very high	96.1	Very high	4 Å²	4	71.6 Å²	71.6	4%	0.041	37%	0.366	C	S	.	.	S	Bend	trans	68	-165.9	-175.9	0	0	0	0	0	112.8	F99 G100 L101 E102 E103	F99-G132 WeakPolarHBondContact CE1-O 3.29Å; G100-G132 CarbonylContact C-O 3.58Å; G100-G132 VanDerWaalsContact CA-O 3.3Å; G100-G132 WeakPolarHBondContact CA-O 3.14Å; L101-G132 PolarHBondContact N-O 3.35Å; L101-G132 CarbonylContact O-C 3.57Å; L101-G132 WeakPolarHBondContact O-CA 3.38Å; E102-G132 WeakPolarHBondContact O-CA 3.38Å; E102-G132 PolarHBondContact O-N 3.07Å; E103-G132 VanDerWaalsContact OE2-CA 3.32Å; E103-G132 WeakPolarHBondContact OE2-CA 3.49Å
133	H	95.7	Very high	96.3	Very high	114 Å²	114	73.3 Å²	73.3	53%	0.528	36%	0.355	S	S	.	.	S	Bend	trans	-136	3	-176.8	69.7	-73.7	0	0	0	113.9	E103 K160	E103-H133 IonicContact OE1-CE1 3.12Å; E103-H133 PolarHBondContact OE1-CE1 3Å; E103-H133 IonicContact OE1-CG 3.01Å; E103-H133 IonicContact OE1-ND1 2.88Å; E103-H133 PolarHBondContact OE1-ND1 3.47Å; E103-H133 IonicContact OE2-ND1 3.86Å; H133-K160 PolarHBondContact ND1-NZ 3.32Å
134	K	89.3	Confident	96.4	Very high	179 Å²	179	72.7 Å²	72.7	78%	0.778	35%	0.349	S	S	*	.	S	Bend	trans	-72.4	-38.9	-172.2	-171.6	-175	172.8	-167.4	0	112.3
135	E	91.1	Very high	96.4	Very high	142 Å²	142	70.9 Å²	70.9	66%	0.664	34%	0.336	S	S	*	.	S	Bend	trans	-134.9	140	-175.7	-66.7	177.6	-160.9	0	0	110
136	I	96.9	Very high	96.3	Very high	78 Å²	78	70.9 Å²	70.9	40%	0.4	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-81.3	132.2	175.2	-59.8	157.6	0	0	0	107.4	F95 H97	F95-I136 HydrophobicContact CB-CG2 3.83Å; H97-I136 HydrophobicContact CB-CD1 4.1Å; H97-I136 WeakPolarHBondContact ND1-CD1 2.97Å
137	P	97.8	Very high	96.3	Very high	8 Å²	8	67.5 Å²	67.5	5%	0.052	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-55.9	144.4	177.1	-26.9	35.8	0	0	0	112.2	F95 F99 W130	F95-P137 HydrophobicContact CB-CB 4.5Å; F95-P137 HydrophobicContact CD1-CB 4.05Å; F95-P137 HydrophobicContact CD1-CG 3.75Å; F95-P137 HydrophobicContact CD2-CB 3.61Å; F95-P137 HydrophobicContact CD2-CG 4.25Å; F95-P137 HydrophobicContact CE1-CB 4.13Å; F95-P137 HydrophobicContact CE1-CG 3.87Å; F95-P137 HydrophobicContact CE2-CB 3.7Å; F95-P137 HydrophobicContact CE2-CG 4.35Å; F95-P137 HydrophobicContact CG-CB 3.79Å; F95-P137 HydrophobicContact CG-CG 3.94Å; F95-P137 HydrophobicContact CZ-CB 3.96Å; F95-P137 HydrophobicContact CZ-CG 4.17Å; F99-P137 HydrophobicContact CD1-CG 4.21Å; F99-P137 HydrophobicContact CD2-CG 4.23Å; F99-P137 HydrophobicContact CE1-CG 4.06Å; F99-P137 HydrophobicContact CE2-CG 4.11Å; F99-P137 HydrophobicContact CG-CG 4.29Å; F99-P137 HydrophobicContact CZ-CG 4.01Å; W130-P137 HydrophobicContact CB-CB 4.41Å; W130-P137 HydrophobicContact CB-CG 3.66Å; W130-P137 HydrophobicContact CD2-CB 3.75Å; W130-P137 HydrophobicContact CD2-CG 3.99Å; W130-P137 HydrophobicContact CE3-CB 4.39Å; W130-P137 HydrophobicContact CG-CB 3.73Å; W130-P137 HydrophobicContact CG-CG 3.51Å
138	P	97.8	Very high	96.4	Very high	82 Å²	82	64.6 Å²	64.6	53%	0.532	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-65.8	162.6	-178.4	29.1	-35.4	0	0	0	111.4	W130	W130-P138 HydrophobicContact CZ2-CG 4.47Å
139	R	98	Very high	96.5	Very high	178 Å²	178	63.9 Å²	63.9	67%	0.672	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-63.1	141	167.5	-72	-177.2	-180	-117.1	-0.8	109.9	L93 A94	L93-R139 WeakPolarHBondContact O-CA 3.38Å; A94-R139 HydrophobicContact CB-CG 4.14Å
140	I	98.1	Very high	96.5	Very high	9 Å²	9	59.2 Å²	59.2	5%	0.046	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.1	-177.8	-57	165.8	0	0	0	108.1	Q92 L93 F95 V116 R127 W130 I147	Q92-I140 CarbonylContact C-O 3.6Å; Q92-I140 WeakPolarHBondContact CA-O 3.44Å; L93-I140 HydrophobicContact CB-CB 4.33Å; L93-I140 PolarHBondContact N-O 2.75Å; L93-I140 PolarHBondContact O-N 3Å; F95-I140 HydrophobicContact CE2-CD1 4.2Å; V116-I140 HydrophobicContact CB-CD1 3.94Å; V116-I140 HydrophobicContact CG1-CD1 3.91Å; V116-I140 HydrophobicContact CG1-CG2 4.38Å; V116-I140 HydrophobicContact CG2-CD1 3.95Å; R127-I140 HydrophobicContact CB-CG2 4.34Å; R127-I140 HydrophobicContact CG-CG2 4.47Å; W130-I140 HydrophobicContact CH2-CD1 3.36Å; W130-I140 HydrophobicContact CH2-CG1 4.42Å; W130-I140 HydrophobicContact CZ2-CD1 4.11Å; W130-I140 HydrophobicContact CZ3-CD1 3.93Å; I140-I147 HydrophobicContact CG2-CD1 4.17Å
141	T	97.4	Very high	96.5	Very high	42 Å²	42	57 Å²	57	26%	0.258	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.5	164.2	-52.4	0	0	0	0	107.7	R90 I91 V170	R90-T141 HydrophobicContact CB-CG2 3.99Å; I91-T141 WeakPolarHBondContact O-CA 3.34Å; T141-V170 HydrophobicContact CG2-CG2 4.27Å
142	S	96.3	Very high	96.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.28	C	S	.	.			trans	-58.4	159.3	178.2	64.8	0	0	0	0	111.4	R90 I91 D118 T144	R90-S142 PolarHBondContact NE-O 2.84Å; R90-S142 PolarHBondContact NH2-O 2.82Å; I91-S142 PolarHBondContact N-OG 3.3Å; I91-S142 PolarHBondContact O-N 2.84Å; I91-S142 PolarHBondContact O-OG 2.86Å; D118-S142 WeakPolarHBondContact OD1-CA 3.43Å; D118-S142 VanDerWaalsContact OD1-CB 3.29Å; D118-S142 WeakPolarHBondContact OD1-CB 3.48Å; S142-T144 WeakPolarHBondContact CB-O 3.4Å; S142-T144 PolarHBondContact OG-O 3.06Å
143	R	93.8	Very high	96.6	Very high	151 Å²	151	59.6 Å²	59.6	57%	0.57	28%	0.279	S	S	*	.	S	Bend	trans	-81.5	-28.3	173.8	-75.3	173.1	178.1	-165.1	-0.2	113	D118	D118-R143 HydrophobicContact CB-CB 4.5Å; D118-R143 VanDerWaalsContact CG-N 3.33Å; D118-R143 PolarHBondContact OD1-N 3.31Å; D118-R143 VanDerWaalsContact OD2-CG 3.27Å; D118-R143 WeakPolarHBondContact OD2-CG 3.29Å; D118-R143 PolarHBondContact OD2-N 3.16Å
144	T	93.4	Very high	96.6	Very high	46 Å²	46	55.7 Å²	55.7	28%	0.282	26%	0.262	S	S	.	.	S	Bend	trans	-125.9	-173.7	-177.7	66.7	0	0	0	0	109.8	V119 S142 Q146	V119-T144 PolarHBondContact O-OG1 2.96Å; S142-T144 WeakPolarHBondContact CB-O 3.4Å; S142-T144 PolarHBondContact OG-O 3.06Å; T144-Q146 PolarHBondContact O-N 2.94Å; T144-Q146 PolarHBondContact OG1-N 3.33Å; T144-Q146 VanDerWaalsContact OG1-N 3.14Å; T144-Q146 PolarHBondContact OG1-O 2.81Å
145	N	95.3	Very high	96.9	Very high	40 Å²	40	52.8 Å²	52.8	21%	0.214	26%	0.255	C	S	.	.	S	Bend	trans	-77	13.6	170.1	69.3	-46.9	0	0	0	113.3	H84 S85 Q86 T89	H84-N145 CarbonylContact C-O 3.57Å; H84-N145 WeakPolarHBondContact CA-O 3.2Å; S85-N145 PolarHBondContact N-O 2.84Å; S85-N145 PolarHBondContact O-ND2 2.7Å; S85-N145 WeakPolarHBondContact OG-CA 3.35Å; S85-N145 WeakPolarHBondContact OG-CB 3.27Å; S85-N145 PolarHBondContact OG-O 2.8Å; Q86-N145 WeakPolarHBondContact O-CB 3.27Å; T89-N145 WeakPolarHBondContact O-CA 3.38Å; T89-N145 WeakPolarHBondContact O-CB 3.39Å; T89-N145 PolarHBondContact O-N 3.35Å
146	Q	96.7	Very high	97	Very high	50 Å²	50	53.3 Å²	53.3	23%	0.234	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.9	-178.7	-47.1	-172.9	31.8	0	0	111	L83 H84 T144	L83-Q146 WeakPolarHBondContact O-CA 3.41Å; H84-Q146 PolarHBondContact CE1-OE1 3.21Å; H84-Q146 WeakPolarHBondContact ND1-CG 3.34Å; H84-Q146 PolarHBondContact ND1-OE1 3.35Å; T144-Q146 PolarHBondContact O-N 2.94Å; T144-Q146 PolarHBondContact OG1-N 3.33Å; T144-Q146 VanDerWaalsContact OG1-N 3.14Å; T144-Q146 PolarHBondContact OG1-O 2.81Å
147	I	98.1	Very high	96.9	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	142.7	174.3	-163.6	162.3	0	0	0	109.8	L83 I91 L93 V116 E117 I140	L83-I147 HydrophobicContact CB-CG2 3.86Å; L83-I147 HydrophobicContact CD2-CG2 4.37Å; L83-I147 PolarHBondContact N-O 3Å; L83-I147 PolarHBondContact O-N 2.79Å; I91-I147 HydrophobicContact CB-CG2 4.03Å; I91-I147 HydrophobicContact CD1-CG2 3.91Å; I91-I147 HydrophobicContact CG2-CG2 3.83Å; L93-I147 HydrophobicContact CD1-CD1 3.66Å; L93-I147 HydrophobicContact CD1-CG1 4.32Å; L93-I147 HydrophobicContact CD1-CG2 4.42Å; L93-I147 HydrophobicContact CD2-CG2 4.5Å; L93-I147 HydrophobicContact CG-CD1 4.24Å; V116-I147 HydrophobicContact CG1-CD1 3.49Å; V116-I147 VanDerWaalsContact CG1-CD1 3.49Å; V116-I147 HydrophobicContact CG1-CG1 3.77Å; E117-I147 WeakPolarHBondContact O-CG1 3.45Å; I140-I147 HydrophobicContact CG2-CD1 4.17Å
148	K	98.8	Very high	96.7	Very high	37 Å²	37	55 Å²	55	16%	0.161	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134.4	179.7	-174.7	-174.5	62	165.3	0	109.6	T80 W81 R82 V116 E117 V119	T80-K148 HydrophobicContact CG2-CD 3.92Å; T80-K148 HydrophobicContact CG2-CG 3.75Å; W81-K148 CarbonylContact O-C 3.58Å; W81-K148 WeakPolarHBondContact O-CA 3.3Å; R82-K148 HydrophobicContact CG-CB 4.49Å; R82-K148 HydrophobicContact CG-CD 4.49Å; R82-K148 HydrophobicContact CG-CG 4.05Å; V116-K148 WeakPolarHBondContact CA-O 3.41Å; E117-K148 HydrophobicContact CB-CB 4.47Å; E117-K148 PolarHBondContact N-O 2.77Å; E117-K148 PolarHBondContact O-N 2.83Å; E117-K148 IonicContact OE1-NZ 3.8Å; E117-K148 PolarHBondContact OE1-NZ 3.35Å; E117-K148 WeakPolarHBondContact OE2-CE 3.3Å; E117-K148 IonicContact OE2-NZ 3.56Å; E117-K148 PolarHBondContact OE2-NZ 3.44Å; V119-K148 HydrophobicContact CG2-CB 3.64Å; V119-K148 HydrophobicContact CG2-CD 4.45Å
149	I	98.9	Very high	96.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.9	175.3	-54	171.8	0	0	0	107.1	V64 T80 W81 L83 L93 V114 E115 V116 I165	V64-I149 HydrophobicContact CG2-CD1 3.88Å; T80-I149 CarbonylContact C-O 3.56Å; T80-I149 WeakPolarHBondContact CA-O 3.36Å; W81-I149 HydrophobicContact CB-CB 4.44Å; W81-I149 HydrophobicContact CE3-CB 4.2Å; W81-I149 HydrophobicContact CE3-CG2 4.02Å; W81-I149 HydrophobicContact CZ3-CG2 4.44Å; W81-I149 PolarHBondContact N-O 3.01Å; W81-I149 PolarHBondContact O-N 3.46Å; L83-I149 HydrophobicContact CD1-CD1 4.26Å; L83-I149 HydrophobicContact CD2-CD1 4.48Å; L93-I149 HydrophobicContact CD1-CD1 3.85Å; L93-I149 HydrophobicContact CD1-CG1 4.05Å; L93-I149 HydrophobicContact CD2-CD1 4.17Å; V114-I149 HydrophobicContact CG2-CG2 3.77Å; E115-I149 CarbonylContact O-C 3.58Å; E115-I149 WeakPolarHBondContact O-CA 3.46Å; V116-I149 HydrophobicContact CG2-CG1 4.34Å; I149-I165 HydrophobicContact CD1-CD1 4.26Å; I149-I165 HydrophobicContact CD1-CG2 4.33Å; I149-I165 HydrophobicContact CG2-CD1 3.91Å
150	T	98.9	Very high	96.6	Very high	15 Å²	15	48.6 Å²	48.6	9%	0.092	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.1	177.9	-52.5	0	0	0	0	108.9	L78 L79 V114 E115	L78-T150 HydrophobicContact CD1-CG2 3.91Å; L79-T150 CarbonylContact O-C 3.48Å; L79-T150 WeakPolarHBondContact O-CA 3.19Å; V114-T150 CarbonylContact C-O 3.54Å; V114-T150 WeakPolarHBondContact CA-O 3.21Å; E115-T150 PolarHBondContact N-O 3.5Å; E115-T150 PolarHBondContact O-N 3.14Å
151	F	98.8	Very high	96.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127	168.3	174.5	-128.5	0	0	0	109.9	Y73 L77 L78 L79 W81 L101 F113 F163	Y73-F151 HydrophobicContact CD1-CZ 4.4Å; Y73-F151 HydrophobicContact CD2-CE1 4.3Å; Y73-F151 AromaticContact CD2-CZ 3.68Å; Y73-F151 HydrophobicContact CD2-CZ 3.68Å; Y73-F151 AromaticContact CE2-CZ 3.99Å; Y73-F151 HydrophobicContact CE2-CZ 3.99Å; Y73-F151 HydrophobicContact CG-CE1 4.37Å; Y73-F151 AromaticContact CG-CZ 3.89Å; Y73-F151 HydrophobicContact CG-CZ 3.89Å; L77-F151 HydrophobicContact CB-CD1 4.49Å; L77-F151 HydrophobicContact CB-CE1 4.38Å; L77-F151 HydrophobicContact CD1-CD1 4.24Å; L77-F151 HydrophobicContact CD1-CE1 3.62Å; L78-F151 WeakPolarHBondContact CA-O 3.43Å; L79-F151 HydrophobicContact CB-CB 4.42Å; L79-F151 HydrophobicContact CD1-CD1 4.09Å; L79-F151 HydrophobicContact CG-CD1 4.4Å; L79-F151 PolarHBondContact N-O 3.02Å; L79-F151 PolarHBondContact O-N 3.24Å; W81-F151 HydrophobicContact CH2-CB 4.4Å; W81-F151 HydrophobicContact CZ3-CB 3.97Å; L101-F151 HydrophobicContact CD1-CD2 4.44Å; L101-F151 HydrophobicContact CD1-CE2 4.03Å; L101-F151 HydrophobicContact CD2-CE2 3.7Å; L101-F151 HydrophobicContact CD2-CZ 4.13Å; F113-F151 WeakPolarHBondContact O-CA 3.43Å; F113-F151 VanDerWaalsContact O-CD2 3.23Å; F113-F151 WeakPolarHBondContact O-CD2 3.41Å; F151-F163 HydrophobicContact CB-CE1 3.69Å; F151-F163 HydrophobicContact CB-CZ 3.76Å; F151-F163 AromaticContact CD1-CE1 3.87Å; F151-F163 HydrophobicContact CD1-CE1 3.87Å; F151-F163 HydrophobicContact CD1-CZ 4.4Å; F151-F163 HydrophobicContact CD2-CD1 4.25Å; F151-F163 AromaticContact CD2-CE1 3.52Å; F151-F163 HydrophobicContact CD2-CE1 3.52Å; F151-F163 HydrophobicContact CD2-CZ 4.44Å; F151-F163 HydrophobicContact CE1-CE1 4.33Å; F151-F163 HydrophobicContact CE2-CE1 4.08Å; F151-F163 AromaticContact CG-CE1 3.42Å; F151-F163 HydrophobicContact CG-CE1 3.42Å; F151-F163 VanDerWaalsContact CG-CE1 3.42Å; F151-F163 AromaticContact CG-CZ 3.99Å; F151-F163 HydrophobicContact CG-CZ 3.99Å; F151-F163 HydrophobicContact CZ-CE1 4.45Å
152	Q	98.7	Very high	96.6	Very high	74 Å²	74	48.1 Å²	48.1	35%	0.346	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.2	173.4	-176.6	174.6	-36	0	0	109.7	L77 L78 D112 F113	L77-Q152 VanDerWaalsContact O-CA 3.29Å; L77-Q152 WeakPolarHBondContact O-CA 3.14Å; L78-Q152 HydrophobicContact CD1-CB 4.46Å; D112-Q152 WeakPolarHBondContact CA-O 2.77Å; F113-Q152 HydrophobicContact CD1-CB 4.33Å; F113-Q152 HydrophobicContact CE1-CB 3.79Å; F113-Q152 HydrophobicContact CE1-CG 4.17Å; F113-Q152 HydrophobicContact CE2-CB 3.99Å; F113-Q152 HydrophobicContact CZ-CB 3.6Å; F113-Q152 HydrophobicContact CZ-CG 4.24Å; F113-Q152 PolarHBondContact N-O 3.38Å; F113-Q152 PolarHBondContact O-N 3.26Å
153	S	98.1	Very high	96.8	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	146.1	165	74.7	0	0	0	0	110.9	P74 R75 N76 L77 D112	P74-S153 PolarHBondContact O-OG 3.11Å; R75-S153 VanDerWaalsContact C-OG 3.3Å; R75-S153 WeakPolarHBondContact CA-OG 3.12Å; N76-S153 PolarHBondContact N-OG 2.99Å; N76-S153 VanDerWaalsContact N-OG 3.1Å; L77-S153 WeakPolarHBondContact CB-OG 3.3Å; L77-S153 PolarHBondContact N-O 2.79Å; L77-S153 PolarHBondContact N-OG 3.1Å; L77-S153 PolarHBondContact O-N 2.87Å; D112-S153 WeakPolarHBondContact OD1-CA 3.35Å; D112-S153 VanDerWaalsContact OD1-CB 3.3Å; D112-S153 WeakPolarHBondContact OD1-CB 3.28Å
154	D	96.7	Very high	97	Very high	32 Å²	32	42.9 Å²	42.9	17%	0.171	22%	0.221	C	C	.	.			trans	-78.1	-170.9	179.8	81.8	-3.3	0	0	0	112.9	R75 N76 D112 Y156	R75-D154 CarbonylContact C-O 3.58Å; R75-D154 WeakPolarHBondContact CB-O 3.44Å; N76-D154 PolarHBondContact N-O 3.36Å; D112-D154 PolarHBondContact OD1-N 3.25Å; D154-Y156 VanDerWaalsContact C-N 3.26Å; D154-Y156 PolarHBondContact O-N 3.42Å; D154-Y156 WeakPolarHBondContact OD1-CA 3.09Å; D154-Y156 WeakPolarHBondContact OD1-CB 3.35Å; D154-Y156 PolarHBondContact OD1-N 3Å
155	D	95.2	Very high	97.3	Very high	118 Å²	118	40.7 Å²	40.7	63%	0.631	21%	0.207	S	C	*	.	S	Bend	trans	-85.9	7.5	-178.1	69.6	-22.3	0	0	0	114.2	R75 N76	R75-D155 WeakPolarHBondContact CD-O 3.04Å; R75-D155 PolarHBondContact NE-O 2.72Å; N76-D155 WeakPolarHBondContact OD1-CA 3.4Å; N76-D155 WeakPolarHBondContact OD1-CB 3.3Å; N76-D155 PolarHBondContact OD1-N 2.82Å
156	Y	94.3	Very high	97.4	Very high	154 Å²	154	43.7 Å²	43.7	60%	0.604	22%	0.216	S	C	*	.	S	Bend	trans	-103.6	149.3	177	-163.3	-104.6	0	0	0	111.7	R75 D154 V158	R75-Y156 WeakPolarHBondContact CB-O 3.33Å; D154-Y156 VanDerWaalsContact C-N 3.26Å; D154-Y156 PolarHBondContact O-N 3.42Å; D154-Y156 WeakPolarHBondContact OD1-CA 3.09Å; D154-Y156 WeakPolarHBondContact OD1-CB 3.35Å; D154-Y156 PolarHBondContact OD1-N 3Å; Y156-V158 HydrophobicContact CD1-CG1 4.11Å
157	F	93.5	Very high	97.5	Very high	101 Å²	101	43 Å²	43	44%	0.443	21%	0.212	S	C	.	.			trans	-94.5	127	178.3	175.2	-95.6	0	0	0	110.7	A159	F157-A159 HydrophobicContact CE1-CB 4.3Å
158	V	93.7	Very high	97.5	Very high	20 Å²	20	44.1 Å²	44.1	12%	0.121	22%	0.22	C	C	.	.			trans	-122.9	139.4	171.3	-62.8	0	0	0	0	111.9	Y73 E102 D112 Y156 K160	Y73-V158 HydrophobicContact CE1-CG2 4.46Å; Y73-V158 HydrophobicContact CE2-CG2 3.85Å; Y73-V158 WeakPolarHBondContact OH-CG2 3.37Å; E102-V158 HydrophobicContact CB-CG1 4.21Å; E102-V158 HydrophobicContact CB-CG2 4.15Å; E102-V158 HydrophobicContact CG-CG1 4.04Å; D112-V158 VanDerWaalsContact OD2-CG2 3.3Å; D112-V158 WeakPolarHBondContact OD2-CG2 3.41Å; Y156-V158 HydrophobicContact CD1-CG1 4.11Å; V158-K160 HydrophobicContact CB-CG 4.25Å; V158-K160 HydrophobicContact CG2-CB 4.36Å; V158-K160 HydrophobicContact CG2-CG 4.12Å; V158-K160 PolarHBondContact O-N 2.77Å; V158-K160 VanDerWaalsContact O-N 3.13Å
159	A	96.4	Very high	97.4	Very high	78 Å²	78	45.8 Å²	45.8	65%	0.645	23%	0.227	S	C	*	.			trans	-86.9	75.6	177.6	0	0	0	0	0	110.7	S72 F157	S72-A159 WeakPolarHBondContact OG-CA 3.43Å; F157-A159 HydrophobicContact CE1-CB 4.3Å
160	K	97.9	Very high	97.2	Very high	47 Å²	47	47.7 Å²	47.7	20%	0.204	24%	0.239	C	C	.	.			trans	-128	141.2	-177.4	-68.6	-74.5	-178.1	162.8	0	111.5	S72 Y73 G100 L101 E103 H133 V158 G162	S72-K160 VanDerWaalsContact CA-O 3.22Å; S72-K160 WeakPolarHBondContact CA-O 3.34Å; Y73-K160 WeakPolarHBondContact CD1-O 3.16Å; Y73-K160 HydrophobicContact CE1-CB 3.65Å; G100-K160 WeakPolarHBondContact O-CB 3.1Å; L101-K160 WeakPolarHBondContact O-CD 3.16Å; E103-K160 IonicContact OE1-NZ 2.77Å; E103-K160 PolarHBondContact OE1-NZ 3.31Å; H133-K160 PolarHBondContact ND1-NZ 3.32Å; V158-K160 HydrophobicContact CB-CG 4.25Å; V158-K160 HydrophobicContact CG2-CB 4.36Å; V158-K160 HydrophobicContact CG2-CG 4.12Å; V158-K160 PolarHBondContact O-N 2.77Å; V158-K160 VanDerWaalsContact O-N 3.13Å; K160-G162 PolarHBondContact O-N 2.86Å; K160-G162 VanDerWaalsContact O-N 3.09Å
161	P	97.8	Very high	96.7	Very high	42 Å²	42	52.6 Å²	52.6	27%	0.273	26%	0.261	S	S	.	.			trans	-64.5	-19.2	-168.2	26.8	-36.2	0	0	0	114.4	F69 P70 Q98	F69-P161 WeakPolarHBondContact CD2-O 3.36Å; P70-P161 CarbonylContact C-O 3.58Å; P70-P161 VanDerWaalsContact O-CA 3.31Å; P70-P161 WeakPolarHBondContact O-CA 3.26Å; P70-P161 WeakPolarHBondContact O-CB 3.43Å; Q98-P161 VanDerWaalsContact O-CG 3.3Å; Q98-P161 WeakPolarHBondContact O-CG 3.2Å
162	G	98.4	Very high	95.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	87.9	-142.5	-177.3	0	0	0	0	0	112	S66 G100 K160	S66-G162 VanDerWaalsContact OG-CA 3.29Å; S66-G162 WeakPolarHBondContact OG-CA 3.28Å; G100-G162 PolarHBondContact N-O 2.9Å; G100-G162 VanDerWaalsContact O-CA 3.28Å; G100-G162 WeakPolarHBondContact O-CA 3.45Å; G100-G162 PolarHBondContact O-N 3.12Å; K160-G162 PolarHBondContact O-N 2.86Å; K160-G162 VanDerWaalsContact O-N 3.09Å
163	F	98.8	Very high	93.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.29	C	S	.	.			trans	-145.2	158.7	177	67.4	-90.2	0	0	0	111.9	Q65 S66 F69 W81 F99 L101 V114 F151 I165	Q65-F163 CarbonylContact C-O 3.58Å; Q65-F163 VanDerWaalsContact CA-O 3.23Å; Q65-F163 WeakPolarHBondContact CA-O 3.25Å; Q65-F163 VanDerWaalsContact CB-O 3.27Å; Q65-F163 WeakPolarHBondContact CB-O 3.32Å; S66-F163 PolarHBondContact N-O 3.31Å; S66-F163 PolarHBondContact OG-N 2.99Å; S66-F163 PolarHBondContact OG-O 3.16Å; F69-F163 WeakPolarHBondContact CD2-O 3.06Å; W81-F163 HydrophobicContact CH2-CE2 4.38Å; W81-F163 AromaticContact CH2-CZ 3.85Å; W81-F163 HydrophobicContact CH2-CZ 3.85Å; W81-F163 HydrophobicContact CZ3-CE2 4.25Å; W81-F163 AromaticContact CZ3-CZ 3.75Å; W81-F163 HydrophobicContact CZ3-CZ 3.75Å; F99-F163 HydrophobicContact CD2-CB 3.63Å; F99-F163 HydrophobicContact CE2-CB 3.97Å; L101-F163 HydrophobicContact CD2-CD1 4.4Å; V114-F163 HydrophobicContact CB-CD1 4.32Å; V114-F163 HydrophobicContact CB-CE1 4.29Å; V114-F163 HydrophobicContact CG2-CE1 4.32Å; V114-F163 HydrophobicContact CG2-CE2 4.43Å; V114-F163 HydrophobicContact CG2-CZ 4.23Å; F151-F163 HydrophobicContact CB-CE1 3.69Å; F151-F163 HydrophobicContact CB-CZ 3.76Å; F151-F163 AromaticContact CD1-CE1 3.87Å; F151-F163 HydrophobicContact CD1-CE1 3.87Å; F151-F163 HydrophobicContact CD1-CZ 4.4Å; F151-F163 HydrophobicContact CD2-CD1 4.25Å; F151-F163 AromaticContact CD2-CE1 3.52Å; F151-F163 HydrophobicContact CD2-CE1 3.52Å; F151-F163 HydrophobicContact CD2-CZ 4.44Å; F151-F163 HydrophobicContact CE1-CE1 4.33Å; F151-F163 HydrophobicContact CE2-CE1 4.08Å; F151-F163 AromaticContact CG-CE1 3.42Å; F151-F163 HydrophobicContact CG-CE1 3.42Å; F151-F163 VanDerWaalsContact CG-CE1 3.42Å; F151-F163 AromaticContact CG-CZ 3.99Å; F151-F163 HydrophobicContact CG-CZ 3.99Å; F151-F163 HydrophobicContact CZ-CE1 4.45Å; F163-I165 HydrophobicContact CD2-CD1 3.67Å; F163-I165 HydrophobicContact CD2-CG1 3.79Å; F163-I165 HydrophobicContact CE2-CD1 3.78Å; F163-I165 HydrophobicContact CE2-CG1 4.31Å
164	K	98.8	Very high	91.3	Very high	41 Å²	41	66.5 Å²	66.5	18%	0.178	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.1	160.5	175.5	-174.1	-68.2	171.7	0	107.8	H63 V64 Q65 F69 D96 Y166	H63-K164 HydrophobicContact CB-CG 4.3Å; V64-K164 CarbonylContact O-C 3.6Å; V64-K164 WeakPolarHBondContact O-CA 3.26Å; Q65-K164 HydrophobicContact CB-CB 3.95Å; Q65-K164 HydrophobicContact CB-CG 4.17Å; F69-K164 HydrophobicContact CD1-CB 3.93Å; F69-K164 HydrophobicContact CD2-CB 4.46Å; F69-K164 HydrophobicContact CE1-CB 3.64Å; F69-K164 HydrophobicContact CE1-CD 4.17Å; F69-K164 HydrophobicContact CE2-CB 4.21Å; F69-K164 HydrophobicContact CG-CB 4.34Å; F69-K164 HydrophobicContact CZ-CB 3.77Å; D96-K164 HydrophobicContact CB-CB 3.82Å; D96-K164 HydrophobicContact CB-CG 4.41Å; D96-K164 WeakPolarHBondContact CB-O 3.37Å; D96-K164 PolarHBondContact N-O 2.96Å; K164-Y166 HydrophobicContact CD-CE1 4Å; K164-Y166 HydrophobicContact CD-CE2 3.93Å; K164-Y166 VanDerWaalsContact CD-CZ 3.46Å; K164-Y166 WeakPolarHBondContact CD-OH 3.44Å; K164-Y166 HydrophobicContact CG-CE2 4.23Å
165	I	98.8	Very high	89	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	117.7	179.1	-62.5	160.2	0	0	0	107.3	H63 V64 L93 A94 F95 V114 I149 F163	H63-I165 CarbonylContact C-O 3.58Å; H63-I165 WeakPolarHBondContact CA-O 3.32Å; H63-I165 WeakPolarHBondContact CB-O 3.12Å; V64-I165 HydrophobicContact CG2-CB 3.99Å; V64-I165 HydrophobicContact CG2-CD1 4.44Å; V64-I165 PolarHBondContact N-O 2.82Å; V64-I165 PolarHBondContact O-N 2.98Å; L93-I165 HydrophobicContact CB-CG2 3.91Å; L93-I165 HydrophobicContact CD2-CG2 4.17Å; L93-I165 HydrophobicContact CG-CG2 4.43Å; A94-I165 CarbonylContact O-C 3.59Å; A94-I165 WeakPolarHBondContact O-CA 3.41Å; F95-I165 HydrophobicContact CD1-CD1 4.14Å; F95-I165 HydrophobicContact CD1-CG1 3.58Å; F95-I165 HydrophobicContact CD2-CG1 4.32Å; F95-I165 HydrophobicContact CE1-CD1 3.45Å; F95-I165 VanDerWaalsContact CE1-CD1 3.45Å; F95-I165 HydrophobicContact CE1-CG1 3.44Å; F95-I165 VanDerWaalsContact CE1-CG1 3.44Å; F95-I165 HydrophobicContact CE2-CD1 4.33Å; F95-I165 HydrophobicContact CE2-CG1 4.21Å; F95-I165 HydrophobicContact CG-CG1 4.03Å; F95-I165 HydrophobicContact CZ-CD1 3.57Å; F95-I165 HydrophobicContact CZ-CG1 3.79Å; V114-I165 HydrophobicContact CG2-CD1 4.06Å; I149-I165 HydrophobicContact CD1-CD1 4.26Å; I149-I165 HydrophobicContact CD1-CG2 4.33Å; I149-I165 HydrophobicContact CG2-CD1 3.91Å; F163-I165 HydrophobicContact CD2-CD1 3.67Å; F163-I165 HydrophobicContact CD2-CG1 3.79Å; F163-I165 HydrophobicContact CE2-CD1 3.78Å; F163-I165 HydrophobicContact CE2-CG1 4.31Å
166	Y	98.9	Very high	86.7	Confident	102 Å²	102	73.6 Å²	73.6	40%	0.4	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	139.9	169.4	-59.4	-85.5	0	0	0	109.4	G62 H63 L93 A94 D96 K164	G62-Y166 CarbonylContact O-C 3.54Å; G62-Y166 VanDerWaalsContact O-CA 3.32Å; G62-Y166 WeakPolarHBondContact O-CA 3.41Å; H63-Y166 HydrophobicContact CB-CD1 3.85Å; H63-Y166 HydrophobicContact CB-CE1 4.25Å; H63-Y166 HydrophobicContact CB-CG 4.43Å; L93-Y166 CarbonylContact C-O 3.56Å; L93-Y166 WeakPolarHBondContact CA-O 3.37Å; A94-Y166 PolarHBondContact N-O 2.85Å; A94-Y166 PolarHBondContact O-N 3.48Å; D96-Y166 HydrophobicContact CB-CE2 4.05Å; D96-Y166 WeakPolarHBondContact OD2-CE2 3.32Å; D96-Y166 PolarHBondContact OD2-OH 3.04Å; D96-Y166 VanDerWaalsContact OD2-OH 3.11Å; K164-Y166 HydrophobicContact CD-CE1 4Å; K164-Y166 HydrophobicContact CD-CE2 3.93Å; K164-Y166 VanDerWaalsContact CD-CZ 3.46Å; K164-Y166 WeakPolarHBondContact CD-OH 3.44Å; K164-Y166 HydrophobicContact CG-CE2 4.23Å
167	Y	98.8	Very high	84.4	Confident	36 Å²	36	70.5 Å²	70.5	14%	0.141	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.8	174.6	62.6	-103.8	0	0	0	111.2	I56 V58 T61 G62 V64 L83 Q92	I56-Y167 HydrophobicContact CD1-CE1 4.48Å; I56-Y167 HydrophobicContact CG2-CE1 4.39Å; I56-Y167 HydrophobicContact CG2-CE2 4.36Å; V58-Y167 HydrophobicContact CB-CD2 4.47Å; V58-Y167 HydrophobicContact CG1-CD2 3.84Å; V58-Y167 HydrophobicContact CG1-CE2 4.19Å; V58-Y167 HydrophobicContact CG2-CD2 3.9Å; V58-Y167 HydrophobicContact CG2-CE2 4.05Å; T61-Y167 CarbonylContact C-O 3.57Å; T61-Y167 VanDerWaalsContact CA-O 3.29Å; T61-Y167 WeakPolarHBondContact CA-O 3.43Å; G62-Y167 PolarHBondContact N-O 3.45Å; G62-Y167 PolarHBondContact O-N 3.18Å; V64-Y167 HydrophobicContact CG1-CD1 4.46Å; V64-Y167 HydrophobicContact CG1-CE1 4.15Å; L83-Y167 HydrophobicContact CD2-CD1 3.68Å; L83-Y167 HydrophobicContact CD2-CD2 4.24Å; L83-Y167 HydrophobicContact CD2-CE1 4.37Å; L83-Y167 HydrophobicContact CD2-CG 3.6Å; Q92-Y167 CarbonylContact O-C 3.59Å; Q92-Y167 VanDerWaalsContact O-CA 3.25Å; Q92-Y167 WeakPolarHBondContact O-CA 3.14Å
168	S	98.1	Very high	82.1	Confident	27 Å²	27	68.9 Å²	68.9	19%	0.189	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	165.6	168.6	65.2	0	0	0	0	109.5	I91 Q92	I91-S168 CarbonylContact C-O 3.59Å; I91-S168 WeakPolarHBondContact CA-O 3.1Å; Q92-S168 PolarHBondContact N-O 3.38Å; Q92-S168 PolarHBondContact O-N 3.28Å
169	F	95.8	Very high	79.7	Confident	72 Å²	72	72.3 Å²	72.3	32%	0.316	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	152.2	165.2	73.1	-85.4	0	0	0	110.3	V58 T59 T89 R90 E171	V58-F169 HydrophobicContact CG1-CB 4.11Å; V58-F169 HydrophobicContact CG1-CD1 4.42Å; T59-F169 VanDerWaalsContact C-CE1 3.45Å; T59-F169 WeakPolarHBondContact O-CE1 3.37Å; T89-F169 HydrophobicContact CG2-CD2 4.11Å; R90-F169 CarbonylContact O-C 3.59Å; R90-F169 WeakPolarHBondContact O-CA 3.34Å; F169-E171 HydrophobicContact CD2-CG 4.38Å; F169-E171 HydrophobicContact CE2-CG 4.14Å
170	V	94.8	Very high	77.5	Confident	39 Å²	39	77.7 Å²	77.7	24%	0.236	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.8	170.4	-64.9	0	0	0	0	108.2	T89 R90 Q92 T141 D172	T89-V170 WeakPolarHBondContact CA-O 3.43Å; T89-V170 WeakPolarHBondContact CB-O 3.4Å; R90-V170 HydrophobicContact CB-CG2 3.97Å; R90-V170 PolarHBondContact N-O 3.13Å; R90-V170 PolarHBondContact O-N 2.85Å; Q92-V170 HydrophobicContact CB-CG1 4.41Å; T141-V170 HydrophobicContact CG2-CG2 4.27Å; V170-D172 WeakPolarHBondContact CG2-OD1 2.96Å; V170-D172 PolarHBondContact O-N 3.09Å
171	E	89.4	Confident	75.3	Confident	119 Å²	119	82.2 Å²	82.2	56%	0.556	44%	0.437	S	S	*	.			trans	-86.3	93.7	173.4	-68.6	-179.1	-172.3	0	0	107.9	T89 F169 F173	T89-E171 HydrophobicContact CG2-CG 4.18Å; F169-E171 HydrophobicContact CD2-CG 4.38Å; F169-E171 HydrophobicContact CE2-CG 4.14Å; E171-F173 HydrophobicContact CB-CD2 3.83Å; E171-F173 HydrophobicContact CB-CE2 3.98Å; E171-F173 HydrophobicContact CG-CE2 4.21Å; E171-F173 PolarHBondContact O-N 2.83Å
172	D	71	Confident	73.2	Confident	67 Å²	67	85 Å²	85	36%	0.358	45%	0.449	S	S	.	.			trans	-80.8	65.9	172.6	-81.1	20.7	0	0	0	108.6	R90 V170 Q174	R90-D172 WeakPolarHBondContact CD-OD2 3.23Å; R90-D172 IonicContact CZ-OD2 3.83Å; R90-D172 IonicContact NE-OD2 3.22Å; R90-D172 IonicContact NH1-OD2 2.71Å; R90-D172 PolarHBondContact NH1-OD2 2.9Å; V170-D172 WeakPolarHBondContact CG2-OD1 2.96Å; V170-D172 PolarHBondContact O-N 3.09Å; D172-Q174 PolarHBondContact O-N 2.52Å
173	F	57.3	Low	70.9	Confident	136 Å²	136	97.2 Å²	97.2	60%	0.596	50%	0.495	S	S	*	.			trans	-80	51.3	160	-66.3	-69.4	0	0	0	109.8	K88 E171	K88-F173 HydrophobicContact CB-CE1 4.32Å; K88-F173 HydrophobicContact CD-CE1 4.3Å; E171-F173 HydrophobicContact CB-CD2 3.83Å; E171-F173 HydrophobicContact CB-CE2 3.98Å; E171-F173 HydrophobicContact CG-CE2 4.21Å; E171-F173 PolarHBondContact O-N 2.83Å
174	Q	53.2	Low	68.6	Low	165 Å²	165	104.9 Å²	104.9	77%	0.771	53%	0.531	S	S	*	.			trans	-102	113	150	-67.6	-168.4	-59.9	0	0	103.8	D172 E176	D172-Q174 PolarHBondContact O-N 2.52Å; Q174-E176 PolarHBondContact O-N 2.9Å; Q174-E176 VanDerWaalsContact O-N 3.13Å
175	P	47.6	Very low	66.1	Low	111 Å²	111	107.9 Å²	107.9	72%	0.721	56%	0.557	S	S	*	*			trans	-46.9	130.9	145.3	-7.4	21.6	0	0	0	103	A177	P175-A177 PolarHBondContact O-N 2.98Å
176	E	47.9	Very low	63.5	Low	189 Å²	189	114.3 Å²	114.3	88%	0.883	60%	0.596	S	S	*	*			trans	-50.6	97.6	142.9	-71.6	-170.8	173.2	0	0	102.5	Q174 A178	Q174-E176 PolarHBondContact O-N 2.9Å; Q174-E176 VanDerWaalsContact O-N 3.13Å; E176-A178 PolarHBondContact O-N 2.99Å
177	A	46.4	Very low	61.1	Low	88 Å²	88	115.1 Å²	115.1	73%	0.727	61%	0.612	S	S	*	*			trans	-49.1	91.7	133.8	0	0	0	0	0	100.3	P175 S179	P175-A177 PolarHBondContact O-N 2.98Å; A177-S179 VanDerWaalsContact C-N 3.25Å; A177-S179 PolarHBondContact O-N 2.87Å
178	A	43.5	Very low	58.4	Low	67 Å²	67	118.1 Å²	118.1	55%	0.554	64%	0.638	S	S	*	*			trans	-28.1	113.9	142.2	0	0	0	0	0	102	E176 E180	E176-A178 PolarHBondContact O-N 2.99Å; A178-E180 PolarHBondContact O-N 2.96Å
179	S	44.8	Very low	56	Low	92 Å²	92	123.2 Å²	123.2	64%	0.643	67%	0.674	S	S	*	*			trans	-54.4	97.1	174	65.9	0	0	0	0	103.1	A177 I181	A177-S179 VanDerWaalsContact C-N 3.25Å; A177-S179 PolarHBondContact O-N 2.87Å; S179-I181 PolarHBondContact O-N 3.32Å
180	E	49.5	Very low	53.3	Low	191 Å²	191	127.9 Å²	127.9	89%	0.893	69%	0.694	S	S	*	*			trans	-72.6	60	170.3	-81.1	-165.4	159.4	0	0	103.7	A178 N182	A178-E180 PolarHBondContact O-N 2.96Å; E180-N182 PolarHBondContact O-N 3.48Å
181	I	51.9	Low	51	Low	143 Å²	143	130.8 Å²	130.8	73%	0.733	72%	0.717	S	S	*	*			trans	-92.7	85	167.3	-47.5	170.9	0	0	0	102.7	S179	S179-I181 PolarHBondContact O-N 3.32Å
182	N	54.3	Low	49	Very low	100 Å²	100	128.3 Å²	128.3	54%	0.535	72%	0.723	S	S	.	*			trans	76	79	149.7	-157.5	30.2	0	0	0	118.9	E180 E184	E180-N182 PolarHBondContact O-N 3.48Å; N182-E184 WeakPolarHBondContact OD1-CB 3.35Å; N182-E184 PolarHBondContact OD1-N 2.71Å; N182-E184 VanDerWaalsContact OD1-N 3.16Å
183	W	50.1	Low	47.4	Very low	257 Å²	257	129.5 Å²	129.5	97%	0.973	73%	0.732	S	S	*	*			trans	-109.9	39.5	133.2	-75.5	114.3	0	0	0	110	S185	W183-S185 PolarHBondContact O-N 3.46Å
184	E	50.4	Low	46.9	Very low	161 Å²	161	128.1 Å²	128.1	75%	0.752	74%	0.739	S	S	*	*			trans	-57.7	123.1	164.9	-73.3	-169.7	153.5	0	0	106.9	N182 V186	N182-E184 WeakPolarHBondContact OD1-CB 3.35Å; N182-E184 PolarHBondContact OD1-N 2.71Å; N182-E184 VanDerWaalsContact OD1-N 3.16Å; E184-V186 PolarHBondContact O-N 2.71Å
185	S	45.5	Very low	46	Very low	104 Å²	104	129.7 Å²	129.7	73%	0.727	74%	0.74	S	S	*	*			trans	-56.1	108.9	-176.2	-43	0	0	0	0	108.4	W183 T187	W183-S185 PolarHBondContact O-N 3.46Å; S185-T187 PolarHBondContact O-N 3.38Å
186	V	43.8	Very low	45.9	Very low	135 Å²	135	132.8 Å²	132.8	82%	0.818	74%	0.744	S	S	*	*			trans	-74.6	67.8	167.3	-167	0	0	0	0	107.5	E184	E184-V186 PolarHBondContact O-N 2.71Å
187	T	48.1	Very low	45.5	Very low	118 Å²	118	129.4 Å²	129.4	72%	0.724	74%	0.741	S	S	*	*			trans	-112	71.7	165.8	-7	0	0	0	0	106.6	S185 S189	S185-T187 PolarHBondContact O-N 3.38Å; T187-S189 PolarHBondContact O-N 2.97Å
188	S	43.3	Very low	45.3	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	74%	0.74	S	S	*	*			trans	-57.8	128.4	159.4	51.5	0	0	0	0	107.9	F190	S188-F190 PolarHBondContact O-N 2.91Å
189	S	46.4	Very low	45.5	Very low	134 Å²	134	132.6 Å²	132.6	94%	0.937	75%	0.751	S	S	*	*			trans	-64.5	99.1	177.9	-58.2	0	0	0	0	109.6	T187	T187-S189 PolarHBondContact O-N 2.97Å
190	F	39.7	Very low	45.2	Very low	170 Å²	170	134.5 Å²	134.5	75%	0.746	76%	0.759	S	S	*	*			trans	-108.4	120.2	159.4	168.4	-104.6	0	0	0	108.4	S188 G192	S188-F190 PolarHBondContact O-N 2.91Å; F190-G192 PolarHBondContact O-N 3.17Å
191	S	47.2	Very low	45.1	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	76%	0.755	S	S	*	*			trans	-53	118.2	175.2	42.3	0	0	0	0	112.8
192	G	47.8	Very low	44.6	Very low	67 Å²	67	133.4 Å²	133.4	69%	0.691	76%	0.758	S	S	*	*			trans	73.6	92.6	143	0	0	0	0	0	117.6	F190	F190-G192 PolarHBondContact O-N 3.17Å
193	V	35.7	Very low	44.4	Very low	92 Å²	92	133.1 Å²	133.1	56%	0.558	76%	0.764	S	S	*	*			trans	-145.4	126.1	134.6	-176	0	0	0	0	107.9	Y195	V193-Y195 HydrophobicContact CB-CD2 4.3Å; V193-Y195 HydrophobicContact CB-CE2 3.69Å; V193-Y195 HydrophobicContact CG1-CD2 4.17Å; V193-Y195 HydrophobicContact CG1-CE1 4.27Å; V193-Y195 HydrophobicContact CG1-CE2 3.57Å; V193-Y195 PolarHBondContact O-N 3.35Å
194	S	47	Very low	44.5	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	75%	0.752	S	S	*	*			trans	-68.6	111.3	172.7	153	0	0	0	0	109.6
195	Y	35.5	Very low	44.6	Very low	199 Å²	199	125.9 Å²	125.9	78%	0.78	75%	0.752	S	S	*	*			trans	-108.2	120.8	162.9	-67.2	-75.5	0	0	0	109.3	V193 S197	V193-Y195 HydrophobicContact CB-CD2 4.3Å; V193-Y195 HydrophobicContact CB-CE2 3.69Å; V193-Y195 HydrophobicContact CG1-CD2 4.17Å; V193-Y195 HydrophobicContact CG1-CE1 4.27Å; V193-Y195 HydrophobicContact CG1-CE2 3.57Å; V193-Y195 PolarHBondContact O-N 3.35Å; Y195-S197 PolarHBondContact O-N 3.22Å
196	H	44.2	Very low	45.7	Very low	176 Å²	176	124.8 Å²	124.8	82%	0.815	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-56.4	124.8	169.8	-89.3	-76.4	0	0	0	109.7	P198	H196-P198 VanDerWaalsContact O-CD 3.27Å; H196-P198 WeakPolarHBondContact O-CD 3Å
197	S	40.9	Very low	46.5	Very low	117 Å²	117	122.1 Å²	122.1	82%	0.818	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-60.3	122	161.2	-89	0	0	0	0	109.4	Y195	Y195-S197 PolarHBondContact O-N 3.22Å
198	P	42	Very low	47.5	Very low	109 Å²	109	122.5 Å²	122.5	71%	0.708	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-80.9	119.5	153.4	6.8	12.9	0	0	0	106.9	H196 V200	H196-P198 VanDerWaalsContact O-CD 3.27Å; H196-P198 WeakPolarHBondContact O-CD 3Å; P198-V200 PolarHBondContact O-N 3.1Å
199	S	46.8	Very low	48.7	Very low	113 Å²	113	119.9 Å²	119.9	79%	0.79	72%	0.715	S	S	*	*			trans	-58.5	106.7	161.8	53.3	0	0	0	0	108.4	M201	S199-M201 PolarHBondContact O-N 3.34Å
200	V	38.3	Very low	49.9	Very low	132 Å²	132	118.4 Å²	118.4	80%	0.8	70%	0.697	S	S	*	*			trans	-84.7	104.3	167.7	-178	0	0	0	0	106.4	P198 D202	P198-V200 PolarHBondContact O-N 3.1Å; V200-D202 PolarHBondContact O-N 2.61Å
201	M	48.1	Very low	51.4	Low	165 Å²	165	115.9 Å²	115.9	81%	0.813	69%	0.691	S	S	*	*			trans	-56.5	122.5	160.8	-83.4	-98.3	-117.8	0	0	107.9	S199 S203	S199-M201 PolarHBondContact O-N 3.34Å; M201-S203 PolarHBondContact O-N 3.26Å; M201-S203 VanDerWaalsContact O-N 3.13Å; M201-S203 PolarHBondContact O-OG 3.11Å
202	D	42.5	Very low	52.7	Low	147 Å²	147	118.9 Å²	118.9	79%	0.786	69%	0.691	S	S	*	*			trans	-52.8	113.2	172	-171.2	13.3	0	0	0	109.7	V200	V200-D202 PolarHBondContact O-N 2.61Å
203	S	48.4	Very low	53.9	Low	94 Å²	94	117.8 Å²	117.8	66%	0.657	68%	0.676	S	S	*	*			trans	-101.9	102	172.6	-52.4	0	0	0	0	105.9	M201 L205	M201-S203 PolarHBondContact O-N 3.26Å; M201-S203 VanDerWaalsContact O-N 3.13Å; M201-S203 PolarHBondContact O-OG 3.11Å; S203-L205 PolarHBondContact O-N 2.71Å
204	T	53	Low	55.1	Low	119 Å²	119	117.5 Å²	117.5	73%	0.73	67%	0.67	S	S	*	*			trans	-54.4	100.9	171.2	43.5	0	0	0	0	109.6	T206	T204-T206 PolarHBondContact O-N 3.03Å; T204-T206 VanDerWaalsContact O-N 3.07Å
205	L	51.6	Low	56.3	Low	146 Å²	146	116.2 Å²	116.2	76%	0.764	67%	0.666	S	S	*	*			trans	-70.3	97	170.9	-91.2	148.8	0	0	0	107.9	S203 A209	S203-L205 PolarHBondContact O-N 2.71Å; L205-A209 HydrophobicContact CD2-CB 4.21Å
206	T	68.8	Low	58.4	Low	82 Å²	82	113.9 Å²	113.9	50%	0.503	66%	0.662	S	S	.	*			trans	-63.7	145.8	170.8	50.3	0	0	0	0	109.6	T204 D208 A209 L210	T204-T206 PolarHBondContact O-N 3.03Å; T204-T206 VanDerWaalsContact O-N 3.07Å; T206-D208 PolarHBondContact O-N 2.78Å; T206-A209 WeakPolarHBondContact O-CB 3.37Å; T206-A209 PolarHBondContact O-N 2.03Å; T206-L210 PolarHBondContact O-N 3.22Å
207	A	61.6	Low	60.1	Low	78 Å²	78	107.9 Å²	107.9	65%	0.645	63%	0.634	S	S	*	*	H	α-helix	trans	-50.6	-34.4	178	0	0	0	0	0	112.6	A209 L210 D211	A207-A209 VanDerWaalsContact C-N 3.3Å; A207-A209 PolarHBondContact O-N 2.85Å; A207-L210 PolarHBondContact O-N 3.45Å; A207-D211 PolarHBondContact O-N 3.22Å
208	D	69.3	Low	61.6	Low	127 Å²	127	109.9 Å²	109.9	68%	0.679	64%	0.635	S	S	*	*	H	α-helix	trans	-65.4	-27.1	177.1	-58	-21.6	0	0	0	114.1	T206 K212	T206-D208 PolarHBondContact O-N 2.78Å; D208-K212 VanDerWaalsContact O-CB 3.26Å; D208-K212 WeakPolarHBondContact O-CB 3.3Å; D208-K212 PolarHBondContact O-N 3Å; D208-K212 VanDerWaalsContact O-N 3.11Å
209	A	68.4	Low	63.6	Low	43 Å²	43	107.6 Å²	107.6	36%	0.355	62%	0.619	S	S	.	*	H	α-helix	trans	-77.7	-33.2	176.9	0	0	0	0	0	111.3	L205 T206 A207 A213	L205-A209 HydrophobicContact CD2-CB 4.21Å; T206-A209 WeakPolarHBondContact O-CB 3.37Å; T206-A209 PolarHBondContact O-N 2.03Å; A207-A209 VanDerWaalsContact C-N 3.3Å; A207-A209 PolarHBondContact O-N 2.85Å; A209-A213 WeakPolarHBondContact O-CB 3.43Å; A209-A213 PolarHBondContact O-N 2.91Å; A209-A213 VanDerWaalsContact O-N 3.1Å
210	L	70.8	Confident	65.1	Low	104 Å²	104	106.5 Å²	106.5	55%	0.545	61%	0.608	S	S	.	*	H	α-helix	trans	-70.9	-45.4	173.6	-176.2	63.5	0	0	0	110.8	T206 A207 K212 A213 I214	T206-L210 PolarHBondContact O-N 3.22Å; A207-L210 PolarHBondContact O-N 3.45Å; L210-K212 VanDerWaalsContact C-N 3.26Å; L210-K212 PolarHBondContact O-N 3.33Å; L210-A213 PolarHBondContact O-N 2.94Å; L210-I214 HydrophobicContact CD1-CD1 4.23Å; L210-I214 HydrophobicContact CG-CD1 3.91Å; L210-I214 VanDerWaalsContact O-CG1 3.28Å; L210-I214 WeakPolarHBondContact O-CG1 3.46Å; L210-I214 PolarHBondContact O-N 3.28Å
211	D	71.6	Confident	67.2	Low	117 Å²	117	104.2 Å²	104.2	63%	0.626	59%	0.588	S	S	*	*	H	α-helix	trans	-61.3	-37.6	177.2	-118.9	28.4	0	0	0	111.5	A207 I214 A215	A207-D211 PolarHBondContact O-N 3.22Å; D211-I214 PolarHBondContact O-N 2.87Å; D211-A215 VanDerWaalsContact O-CB 3.29Å; D211-A215 WeakPolarHBondContact O-CB 3.44Å; D211-A215 PolarHBondContact O-N 2.93Å
212	K	75.2	Confident	68.8	Low	164 Å²	164	99.5 Å²	99.5	71%	0.713	57%	0.566	S	S	*	*	H	α-helix	trans	-69.6	-36.4	175.9	-168.6	176.8	-179.3	-174.9	0	113.2	D208 L210 E216	D208-K212 VanDerWaalsContact O-CB 3.26Å; D208-K212 WeakPolarHBondContact O-CB 3.3Å; D208-K212 PolarHBondContact O-N 3Å; D208-K212 VanDerWaalsContact O-N 3.11Å; L210-K212 VanDerWaalsContact C-N 3.26Å; L210-K212 PolarHBondContact O-N 3.33Å; K212-E216 PolarHBondContact O-N 3.15Å
213	A	71.6	Confident	70.7	Confident	44 Å²	44	94.8 Å²	94.8	36%	0.364	54%	0.541	S	S	.	.	H	α-helix	trans	-70.3	-36.2	175.1	0	0	0	0	0	111.7	A209 L210 E216 F217	A209-A213 WeakPolarHBondContact O-CB 3.43Å; A209-A213 PolarHBondContact O-N 2.91Å; A209-A213 VanDerWaalsContact O-N 3.1Å; L210-A213 PolarHBondContact O-N 2.94Å; A213-E216 WeakPolarHBondContact O-CB 3.42Å; A213-E216 PolarHBondContact O-N 2.95Å; A213-F217 VanDerWaalsContact O-CD2 3.3Å; A213-F217 WeakPolarHBondContact O-CD2 3.29Å; A213-F217 WeakPolarHBondContact O-CE2 3.45Å
214	I	62.7	Low	72.4	Confident	86 Å²	86	91.7 Å²	91.7	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-38.7	175	-66	166	0	0	0	110.4	L210 D211 E216 F217	L210-I214 HydrophobicContact CD1-CD1 4.23Å; L210-I214 HydrophobicContact CG-CD1 3.91Å; L210-I214 VanDerWaalsContact O-CG1 3.28Å; L210-I214 WeakPolarHBondContact O-CG1 3.46Å; L210-I214 PolarHBondContact O-N 3.28Å; D211-I214 PolarHBondContact O-N 2.87Å; I214-E216 PolarHBondContact O-N 3.44Å; I214-F217 PolarHBondContact O-N 2.7Å
215	A	70.6	Confident	73.8	Confident	78 Å²	78	89.2 Å²	89.2	65%	0.645	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-6.5	176.4	0	0	0	0	0	114.5	D211 F217	D211-A215 VanDerWaalsContact O-CB 3.29Å; D211-A215 WeakPolarHBondContact O-CB 3.44Å; D211-A215 PolarHBondContact O-N 2.93Å; A215-F217 VanDerWaalsContact C-N 3.3Å
216	E	79.2	Confident	75.3	Confident	150 Å²	150	90 Å²	90	70%	0.701	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-16.4	176.5	-166	166.9	-170.9	0	0	112.5	K212 A213 I214	K212-E216 PolarHBondContact O-N 3.15Å; A213-E216 WeakPolarHBondContact O-CB 3.42Å; A213-E216 PolarHBondContact O-N 2.95Å; I214-E216 PolarHBondContact O-N 3.44Å
217	F	79.9	Confident	75.7	Confident	51 Å²	51	92.9 Å²	92.9	22%	0.224	50%	0.495	C	S	.	.			trans	-106.2	117.5	-179.1	-60.5	-82.1	0	0	0	111	A213 I214 A215 T219 D222 L223 Y226	A213-F217 VanDerWaalsContact O-CD2 3.3Å; A213-F217 WeakPolarHBondContact O-CD2 3.29Å; A213-F217 WeakPolarHBondContact O-CE2 3.45Å; I214-F217 PolarHBondContact O-N 2.7Å; A215-F217 VanDerWaalsContact C-N 3.3Å; F217-T219 VanDerWaalsContact C-N 3.31Å; F217-T219 PolarHBondContact O-N 2.85Å; F217-D222 HydrophobicContact CD1-CB 4.01Å; F217-L223 HydrophobicContact CB-CB 4.09Å; F217-L223 HydrophobicContact CB-CD1 4.43Å; F217-L223 HydrophobicContact CD2-CD1 4.32Å; F217-L223 HydrophobicContact CD2-CG 4.47Å; F217-L223 HydrophobicContact CG-CB 4.15Å; F217-Y226 HydrophobicContact CE1-CD2 4.3Å; F217-Y226 AromaticContact CE1-CG 3.97Å; F217-Y226 HydrophobicContact CE1-CG 3.97Å; F217-Y226 HydrophobicContact CE2-CD1 4.44Å; F217-Y226 AromaticContact CZ-CD1 3.8Å; F217-Y226 HydrophobicContact CZ-CD1 3.8Å; F217-Y226 AromaticContact CZ-CD2 3.96Å; F217-Y226 HydrophobicContact CZ-CD2 3.96Å; F217-Y226 HydrophobicContact CZ-CE1 4.41Å; F217-Y226 AromaticContact CZ-CG 3.55Å; F217-Y226 HydrophobicContact CZ-CG 3.55Å
218	D	74.4	Confident	76.7	Confident	159 Å²	159	91.8 Å²	91.8	85%	0.85	48%	0.479	S	S	*	.	S	Bend	trans	-75.2	-20.7	179.7	-73	-35.3	0	0	0	112.9
219	T	82.9	Confident	77.3	Confident	61 Å²	61	90.3 Å²	90.3	37%	0.374	48%	0.476	S	S	.	.	S	Bend	trans	-136.5	150.8	-177.9	76.6	0	0	0	0	112.6	F217 E221 D222 L223	F217-T219 VanDerWaalsContact C-N 3.31Å; F217-T219 PolarHBondContact O-N 2.85Å; T219-E221 PolarHBondContact O-N 2.99Å; T219-D222 PolarHBondContact O-N 3.2Å; T219-D222 PolarHBondContact OG1-N 3.46Å; T219-D222 PolarHBondContact OG1-OD2 3.49Å; T219-L223 PolarHBondContact O-N 3.44Å
220	V	79.4	Confident	77.7	Confident	90 Å²	90	92.9 Å²	92.9	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-30.7	174.4	-180	0	0	0	0	111.1	L224 L236 L239	V220-L224 HydrophobicContact CG1-CD1 3.99Å; V220-L224 HydrophobicContact CG1-CG 4.35Å; V220-L224 WeakPolarHBondContact O-CB 3.47Å; V220-L224 VanDerWaalsContact O-CG 3.3Å; V220-L224 WeakPolarHBondContact O-CG 3.29Å; V220-L224 PolarHBondContact O-N 3.39Å; V220-L236 HydrophobicContact CG1-CD1 4.39Å; V220-L239 HydrophobicContact CG1-CD1 4.3Å
221	E	81.8	Confident	78.4	Confident	84 Å²	84	89.6 Å²	89.6	39%	0.393	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-44.7	176.3	-59	-173.2	-176.1	0	0	112.4	T219 L223 L224 K225 L236	T219-E221 PolarHBondContact O-N 2.99Å; E221-L223 VanDerWaalsContact C-N 3.3Å; E221-L223 PolarHBondContact O-N 3.28Å; E221-L224 PolarHBondContact O-N 3.07Å; E221-K225 WeakPolarHBondContact O-CB 3.45Å; E221-K225 VanDerWaalsContact O-CG 3.25Å; E221-K225 WeakPolarHBondContact O-CG 3.19Å; E221-K225 PolarHBondContact O-N 3.08Å; E221-K225 IonicContact OE2-NZ 3.45Å; E221-L236 HydrophobicContact CG-CD1 4.06Å; E221-L236 HydrophobicContact CG-CD2 3.81Å
222	D	81.6	Confident	79.2	Confident	65 Å²	65	86.4 Å²	86.4	35%	0.348	46%	0.462	S	S	.	.	H	α-helix	trans	-69.9	-34.3	-177.4	-61.9	-36.2	0	0	0	111.3	F217 T219 K225 Y226	F217-D222 HydrophobicContact CD1-CB 4.01Å; T219-D222 PolarHBondContact O-N 3.2Å; T219-D222 PolarHBondContact OG1-N 3.46Å; T219-D222 PolarHBondContact OG1-OD2 3.49Å; D222-K225 IonicContact OD1-NZ 2.71Å; D222-K225 PolarHBondContact OD1-NZ 3.28Å; D222-Y226 WeakPolarHBondContact O-CB 3.48Å; D222-Y226 PolarHBondContact O-N 3.03Å; D222-Y226 VanDerWaalsContact O-N 3.08Å
223	L	83.1	Confident	79.5	Confident	49 Å²	49	84.6 Å²	84.6	26%	0.257	46%	0.456	S	S	.	.	H	α-helix	trans	-63.5	-49	171.5	-168.2	144.3	0	0	0	111.1	F217 T219 E221 K225 Y226 F227	F217-L223 HydrophobicContact CB-CB 4.09Å; F217-L223 HydrophobicContact CB-CD1 4.43Å; F217-L223 HydrophobicContact CD2-CD1 4.32Å; F217-L223 HydrophobicContact CD2-CG 4.47Å; F217-L223 HydrophobicContact CG-CB 4.15Å; T219-L223 PolarHBondContact O-N 3.44Å; E221-L223 VanDerWaalsContact C-N 3.3Å; E221-L223 PolarHBondContact O-N 3.28Å; L223-K225 PolarHBondContact O-N 3.34Å; L223-Y226 PolarHBondContact O-N 3.03Å; L223-F227 HydrophobicContact CD1-CE2 4.47Å; L223-F227 HydrophobicContact CD2-CD2 3.67Å; L223-F227 HydrophobicContact CD2-CE2 4.01Å; L223-F227 HydrophobicContact CG-CD2 3.84Å; L223-F227 HydrophobicContact CG-CE2 3.88Å; L223-F227 VanDerWaalsContact O-CD2 3.29Å; L223-F227 WeakPolarHBondContact O-CD2 3.3Å; L223-F227 PolarHBondContact O-N 2.96Å
224	L	83.4	Confident	79.9	Confident	28 Å²	28	87.1 Å²	87.1	15%	0.147	46%	0.464	C	S	.	.	H	α-helix	trans	-65.8	-37.5	179.5	-70.6	172.4	0	0	0	112.4	V220 E221 Y226 N228 W232 D235 L236 L239	V220-L224 HydrophobicContact CG1-CD1 3.99Å; V220-L224 HydrophobicContact CG1-CG 4.35Å; V220-L224 WeakPolarHBondContact O-CB 3.47Å; V220-L224 VanDerWaalsContact O-CG 3.3Å; V220-L224 WeakPolarHBondContact O-CG 3.29Å; V220-L224 PolarHBondContact O-N 3.39Å; E221-L224 PolarHBondContact O-N 3.07Å; L224-Y226 VanDerWaalsContact C-N 3.29Å; L224-Y226 PolarHBondContact O-N 3.01Å; L224-N228 CarbonylContact O-C 3.43Å; L224-N228 WeakPolarHBondContact O-CA 3.49Å; L224-N228 PolarHBondContact O-N 3.42Å; L224-W232 HydrophobicContact CB-CB 3.84Å; L224-W232 WeakPolarHBondContact O-CB 3.43Å; L224-D235 HydrophobicContact CD1-CB 4.41Å; L224-D235 HydrophobicContact CD2-CB 4.25Å; L224-L236 HydrophobicContact CD1-CB 4.04Å; L224-L236 HydrophobicContact CD1-CD1 3.89Å; L224-L239 HydrophobicContact CD1-CD1 4.14Å
225	K	82.8	Confident	80.8	Confident	68 Å²	68	85.5 Å²	85.5	30%	0.296	46%	0.456	S	S	.	.	H	α-helix	trans	-61.3	-38.4	173.5	-75	167.7	-162.8	153.3	0	112.1	E221 D222 L223 P229 W232	E221-K225 WeakPolarHBondContact O-CB 3.45Å; E221-K225 VanDerWaalsContact O-CG 3.25Å; E221-K225 WeakPolarHBondContact O-CG 3.19Å; E221-K225 PolarHBondContact O-N 3.08Å; E221-K225 IonicContact OE2-NZ 3.45Å; D222-K225 IonicContact OD1-NZ 2.71Å; D222-K225 PolarHBondContact OD1-NZ 3.28Å; L223-K225 PolarHBondContact O-N 3.34Å; K225-P229 WeakPolarHBondContact O-CA 3.33Å; K225-P229 WeakPolarHBondContact O-CB 3.44Å; K225-W232 HydrophobicContact CB-CG 4.47Å; K225-W232 HydrophobicContact CD-CD2 4.36Å; K225-W232 HydrophobicContact CD-CE3 4.47Å; K225-W232 HydrophobicContact CD-CH2 4.4Å; K225-W232 HydrophobicContact CD-CZ2 4.27Å; K225-W232 HydrophobicContact CD-CZ3 4.5Å; K225-W232 VanDerWaalsContact CE-CZ2 3.46Å; K225-W232 HydrophobicContact CG-CB 4.42Å; K225-W232 HydrophobicContact CG-CD2 3.43Å; K225-W232 VanDerWaalsContact CG-CD2 3.43Å; K225-W232 HydrophobicContact CG-CE3 3.83Å; K225-W232 HydrophobicContact CG-CG 3.71Å; K225-W232 HydrophobicContact CG-CH2 4.45Å; K225-W232 HydrophobicContact CG-CZ2 4.1Å; K225-W232 HydrophobicContact CG-CZ3 4.32Å
226	Y	81.6	Confident	81.3	Confident	163 Å²	163	83 Å²	83	64%	0.639	43%	0.432	S	S	*	.	H	α-helix	trans	-71.2	-48.2	179.3	-177.8	-96.3	0	0	0	112	F217 D222 L223 L224	F217-Y226 HydrophobicContact CE1-CD2 4.3Å; F217-Y226 AromaticContact CE1-CG 3.97Å; F217-Y226 HydrophobicContact CE1-CG 3.97Å; F217-Y226 HydrophobicContact CE2-CD1 4.44Å; F217-Y226 AromaticContact CZ-CD1 3.8Å; F217-Y226 HydrophobicContact CZ-CD1 3.8Å; F217-Y226 AromaticContact CZ-CD2 3.96Å; F217-Y226 HydrophobicContact CZ-CD2 3.96Å; F217-Y226 HydrophobicContact CZ-CE1 4.41Å; F217-Y226 AromaticContact CZ-CG 3.55Å; F217-Y226 HydrophobicContact CZ-CG 3.55Å; D222-Y226 WeakPolarHBondContact O-CB 3.48Å; D222-Y226 PolarHBondContact O-N 3.03Å; D222-Y226 VanDerWaalsContact O-N 3.08Å; L223-Y226 PolarHBondContact O-N 3.03Å; L224-Y226 VanDerWaalsContact C-N 3.29Å; L224-Y226 PolarHBondContact O-N 3.01Å
227	F	78.6	Confident	81.3	Confident	141 Å²	141	81 Å²	81	62%	0.618	42%	0.422	S	S	*	.	H	α-helix	trans	-76.5	-31.7	-176.9	-79.4	-75.1	0	0	0	113.5	L223	L223-F227 HydrophobicContact CD1-CE2 4.47Å; L223-F227 HydrophobicContact CD2-CD2 3.67Å; L223-F227 HydrophobicContact CD2-CE2 4.01Å; L223-F227 HydrophobicContact CG-CD2 3.84Å; L223-F227 HydrophobicContact CG-CE2 3.88Å; L223-F227 VanDerWaalsContact O-CD2 3.29Å; L223-F227 WeakPolarHBondContact O-CD2 3.3Å; L223-F227 PolarHBondContact O-N 2.96Å
228	N	81.1	Confident	81.1	Confident	56 Å²	56	83.4 Å²	83.4	30%	0.299	44%	0.438	S	S	.	.			trans	-146.2	71	-174.7	-164.6	2.2	0	0	0	113	L224 A230 S231 W232 D235	L224-N228 CarbonylContact O-C 3.43Å; L224-N228 WeakPolarHBondContact O-CA 3.49Å; L224-N228 PolarHBondContact O-N 3.42Å; N228-A230 PolarHBondContact O-N 3.5Å; N228-S231 PolarHBondContact ND2-OG 2.99Å; N228-S231 PolarHBondContact O-N 3.21Å; N228-S231 PolarHBondContact OD1-OG 3.24Å; N228-W232 WeakPolarHBondContact O-CB 3.4Å; N228-W232 PolarHBondContact O-N 3.08Å; N228-D235 PolarHBondContact ND2-OD2 3.32Å
229	P	83.3	Confident	81.1	Confident	95 Å²	95	81.1 Å²	81.1	62%	0.617	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.1	-171.9	24.5	-34.4	0	0	0	114.4	K225	K225-P229 WeakPolarHBondContact O-CA 3.33Å; K225-P229 WeakPolarHBondContact O-CB 3.44Å
230	A	77.1	Confident	80.2	Confident	98 Å²	98	86.5 Å²	86.5	81%	0.81	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-25.3	-177.7	0	0	0	0	0	114	N228	N228-A230 PolarHBondContact O-N 3.5Å
231	S	84.8	Confident	79.3	Confident	34 Å²	34	88.1 Å²	88.1	24%	0.238	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.9	15.7	-178.8	71.8	0	0	0	0	114.8	N228 Q233 D234 D235	N228-S231 PolarHBondContact ND2-OG 2.99Å; N228-S231 PolarHBondContact O-N 3.21Å; N228-S231 PolarHBondContact OD1-OG 3.24Å; S231-Q233 PolarHBondContact O-N 3.2Å; S231-D234 PolarHBondContact O-N 3.27Å; S231-D234 VanDerWaalsContact O-N 3.08Å; S231-D235 PolarHBondContact O-N 3.02Å; S231-D235 PolarHBondContact OG-OD2 2.68Å
232	W	88.3	Confident	77.8	Confident	51 Å²	51	90.9 Å²	90.9	19%	0.193	46%	0.46	C	S	.	.	H	α-helix	trans	-54.3	-26.4	178.7	70.8	-87.1	0	0	0	113.9	L224 K225 N228 L236	L224-W232 HydrophobicContact CB-CB 3.84Å; L224-W232 WeakPolarHBondContact O-CB 3.43Å; K225-W232 HydrophobicContact CB-CG 4.47Å; K225-W232 HydrophobicContact CD-CD2 4.36Å; K225-W232 HydrophobicContact CD-CE3 4.47Å; K225-W232 HydrophobicContact CD-CH2 4.4Å; K225-W232 HydrophobicContact CD-CZ2 4.27Å; K225-W232 HydrophobicContact CD-CZ3 4.5Å; K225-W232 VanDerWaalsContact CE-CZ2 3.46Å; K225-W232 HydrophobicContact CG-CB 4.42Å; K225-W232 HydrophobicContact CG-CD2 3.43Å; K225-W232 VanDerWaalsContact CG-CD2 3.43Å; K225-W232 HydrophobicContact CG-CE3 3.83Å; K225-W232 HydrophobicContact CG-CG 3.71Å; K225-W232 HydrophobicContact CG-CH2 4.45Å; K225-W232 HydrophobicContact CG-CZ2 4.1Å; K225-W232 HydrophobicContact CG-CZ3 4.32Å; N228-W232 WeakPolarHBondContact O-CB 3.4Å; N228-W232 PolarHBondContact O-N 3.08Å; W232-L236 HydrophobicContact CZ3-CD2 4.23Å; W232-L236 VanDerWaalsContact O-CB 3.22Å; W232-L236 WeakPolarHBondContact O-CB 3.25Å; W232-L236 PolarHBondContact O-N 3.18Å
233	Q	80.6	Confident	76.3	Confident	125 Å²	125	93.2 Å²	93.2	58%	0.584	48%	0.477	S	S	*	.	H	α-helix	trans	-72	-45.8	178.7	-66.7	172.7	-28.2	0	0	111.6	S231 D235 L236 E237	S231-Q233 PolarHBondContact O-N 3.2Å; Q233-D235 VanDerWaalsContact C-N 3.34Å; Q233-L236 PolarHBondContact O-N 2.89Å; Q233-E237 WeakPolarHBondContact O-CB 3.45Å; Q233-E237 PolarHBondContact O-N 2.77Å
234	D	80.7	Confident	74.6	Confident	97 Å²	97	96.4 Å²	96.4	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-39.7	176.2	-62.3	-33.6	0	0	0	110.6	S231 E237 N238	S231-D234 PolarHBondContact O-N 3.27Å; S231-D234 VanDerWaalsContact O-N 3.08Å; D234-E237 PolarHBondContact O-N 3.18Å; D234-N238 VanDerWaalsContact O-CG 3.3Å; D234-N238 PolarHBondContact O-N 3.22Å; D234-N238 PolarHBondContact O-ND2 3.35Å
235	D	81.6	Confident	72.7	Confident	53 Å²	53	106.7 Å²	106.7	28%	0.283	54%	0.537	S	S	.	.	H	α-helix	trans	-64.7	-40	177.3	-67.4	-30	0	0	0	111.7	L224 N228 S231 Q233 L239	L224-D235 HydrophobicContact CD1-CB 4.41Å; L224-D235 HydrophobicContact CD2-CB 4.25Å; N228-D235 PolarHBondContact ND2-OD2 3.32Å; S231-D235 PolarHBondContact O-N 3.02Å; S231-D235 PolarHBondContact OG-OD2 2.68Å; Q233-D235 VanDerWaalsContact C-N 3.34Å; D235-L239 PolarHBondContact O-N 3.32Å
236	L	81.3	Confident	70.5	Confident	25 Å²	25	113.7 Å²	113.7	13%	0.131	56%	0.564	C	S	.	*	H	α-helix	trans	-67.1	-41.8	174.3	-169.7	74.4	0	0	0	111.1	V220 E221 L224 W232 Q233 N238 L239 Y240	V220-L236 HydrophobicContact CG1-CD1 4.39Å; E221-L236 HydrophobicContact CG-CD1 4.06Å; E221-L236 HydrophobicContact CG-CD2 3.81Å; L224-L236 HydrophobicContact CD1-CB 4.04Å; L224-L236 HydrophobicContact CD1-CD1 3.89Å; W232-L236 HydrophobicContact CZ3-CD2 4.23Å; W232-L236 VanDerWaalsContact O-CB 3.22Å; W232-L236 WeakPolarHBondContact O-CB 3.25Å; W232-L236 PolarHBondContact O-N 3.18Å; Q233-L236 PolarHBondContact O-N 2.89Å; L236-N238 PolarHBondContact O-N 3.39Å; L236-L239 WeakPolarHBondContact O-CB 3.45Å; L236-L239 PolarHBondContact O-N 3.28Å; L236-Y240 HydrophobicContact CD1-CE2 4.1Å; L236-Y240 HydrophobicContact CG-CD2 4.43Å; L236-Y240 HydrophobicContact CG-CE2 4.15Å; L236-Y240 VanDerWaalsContact O-CD2 3.27Å; L236-Y240 WeakPolarHBondContact O-CD2 3.27Å; L236-Y240 PolarHBondContact O-N 3.49Å
237	E	78.4	Confident	68.4	Low	107 Å²	107	117.4 Å²	117.4	50%	0.5	58%	0.576	S	S	.	*	H	α-helix	trans	-64.2	-41.4	179.6	-171.2	165.6	-165.2	0	0	111.7	Q233 D234 L239 Y240 M241	Q233-E237 WeakPolarHBondContact O-CB 3.45Å; Q233-E237 PolarHBondContact O-N 2.77Å; D234-E237 PolarHBondContact O-N 3.18Å; E237-L239 VanDerWaalsContact C-N 3.29Å; E237-L239 PolarHBondContact O-N 3.37Å; E237-Y240 PolarHBondContact O-N 2.98Å; E237-Y240 VanDerWaalsContact O-N 3.07Å; E237-M241 HydrophobicContact CG-CE 4.08Å; E237-M241 HydrophobicContact CG-CG 4.09Å; E237-M241 VanDerWaalsContact O-CG 3.26Å; E237-M241 WeakPolarHBondContact O-CG 3.26Å; E237-M241 PolarHBondContact O-N 2.97Å
238	N	77.4	Confident	66.2	Low	103 Å²	103	113 Å²	113	55%	0.551	57%	0.571	S	S	*	*	H	α-helix	trans	-61.1	-35.5	176.2	-73.4	-39.5	0	0	0	113	D234 L236 Y240 M241 D242	D234-N238 VanDerWaalsContact O-CG 3.3Å; D234-N238 PolarHBondContact O-N 3.22Å; D234-N238 PolarHBondContact O-ND2 3.35Å; L236-N238 PolarHBondContact O-N 3.39Å; N238-Y240 VanDerWaalsContact C-N 3.26Å; N238-Y240 PolarHBondContact O-N 3Å; N238-M241 PolarHBondContact O-N 3.07Å; N238-D242 PolarHBondContact O-N 3.3Å
239	L	73.1	Confident	63.9	Low	111 Å²	111	121.7 Å²	121.7	58%	0.581	60%	0.6	S	S	*	*	H	α-helix	trans	-64.8	-26.9	175.6	-80.8	160.8	0	0	0	113.5	V220 L224 D235 L236 E237	V220-L239 HydrophobicContact CG1-CD1 4.3Å; L224-L239 HydrophobicContact CD1-CD1 4.14Å; D235-L239 PolarHBondContact O-N 3.32Å; L236-L239 WeakPolarHBondContact O-CB 3.45Å; L236-L239 PolarHBondContact O-N 3.28Å; E237-L239 VanDerWaalsContact C-N 3.29Å; E237-L239 PolarHBondContact O-N 3.37Å
240	Y	63.5	Low	61.5	Low	173 Å²	173	122 Å²	122	68%	0.678	60%	0.604	S	S	*	*	H	α-helix	trans	-95.1	-20.3	177.7	-74.3	-78	0	0	0	113.7	L236 E237 N238	L236-Y240 HydrophobicContact CD1-CE2 4.1Å; L236-Y240 HydrophobicContact CG-CD2 4.43Å; L236-Y240 HydrophobicContact CG-CE2 4.15Å; L236-Y240 VanDerWaalsContact O-CD2 3.27Å; L236-Y240 WeakPolarHBondContact O-CD2 3.27Å; L236-Y240 PolarHBondContact O-N 3.49Å; E237-Y240 PolarHBondContact O-N 2.98Å; E237-Y240 VanDerWaalsContact O-N 3.07Å; N238-Y240 VanDerWaalsContact C-N 3.26Å; N238-Y240 PolarHBondContact O-N 3Å
241	M	60.3	Low	59.4	Low	125 Å²	125	127.1 Å²	127.1	62%	0.616	60%	0.604	S	S	*	*	H	α-helix	trans	-86.4	-26	-180	-65.9	-60.2	157.7	0	0	113.3	E237 N238 T243	E237-M241 HydrophobicContact CG-CE 4.08Å; E237-M241 HydrophobicContact CG-CG 4.09Å; E237-M241 VanDerWaalsContact O-CG 3.26Å; E237-M241 WeakPolarHBondContact O-CG 3.26Å; E237-M241 PolarHBondContact O-N 2.97Å; N238-M241 PolarHBondContact O-N 3.07Å; M241-T243 VanDerWaalsContact C-N 3.28Å; M241-T243 PolarHBondContact O-N 3.39Å
242	D	51.8	Low	57	Low	142 Å²	142	133 Å²	133	76%	0.759	63%	0.627	S	S	*	*			trans	-81.1	73.3	172.3	-102.3	-6.2	0	0	0	111.3	N238 P244	N238-D242 PolarHBondContact O-N 3.3Å; D242-P244 WeakPolarHBondContact O-CD 3.22Å
243	T	48.9	Very low	54.4	Low	114 Å²	114	136.8 Å²	136.8	70%	0.699	65%	0.647	S	S	*	*			trans	-83.7	107.3	154	46.3	0	0	0	0	108.3	M241 R245	M241-T243 VanDerWaalsContact C-N 3.28Å; M241-T243 PolarHBondContact O-N 3.39Å; T243-R245 PolarHBondContact O-N 2.94Å
244	P	48.9	Very low	52.2	Low	116 Å²	116	140.5 Å²	140.5	75%	0.753	66%	0.656	S	S	*	*			trans	-60.7	127.7	165.5	24.7	-31	0	0	0	106.8	D242 Y246	D242-P244 WeakPolarHBondContact O-CD 3.22Å; P244-Y246 PolarHBondContact O-N 3.49Å
245	R	42.7	Very low	50.2	Low	243 Å²	243	145.2 Å²	145.2	92%	0.917	67%	0.672	S	S	*	*			trans	-57.9	86.3	168.2	-73.2	-160.6	-177.3	-167.9	3.8	109.4	T243 R247	T243-R245 PolarHBondContact O-N 2.94Å; R245-R247 VanDerWaalsContact C-N 3.29Å; R245-R247 PolarHBondContact O-N 2.98Å
246	Y	36.2	Very low	48.2	Very low	216 Å²	216	147.4 Å²	147.4	85%	0.847	69%	0.691	S	S	*	*			trans	-72.5	89.3	161	-170	-96	0	0	0	107.3	P244 G248	P244-Y246 PolarHBondContact O-N 3.49Å; Y246-G248 PolarHBondContact O-N 3.45Å
247	R	38.5	Very low	46.3	Very low	240 Å²	240	156.2 Å²	156.2	91%	0.906	73%	0.729	S	S	*	*			trans	-84.9	84.4	172.1	-162.8	177	-155.9	175.4	5.6	109.2	R245	R245-R247 VanDerWaalsContact C-N 3.29Å; R245-R247 PolarHBondContact O-N 2.98Å
248	G	31.1	Very low	44.2	Very low	50 Å²	50	155 Å²	155	52%	0.515	74%	0.744	S	S	.	*			trans	-62.7	140.6	166	0	0	0	0	0	111.8	Y246	Y246-G248 PolarHBondContact O-N 3.45Å
249	R	32.7	Very low	42.5	Very low	238 Å²	238	156.4 Å²	156.4	90%	0.898	76%	0.757	S	S	*	*			trans	-68	139.6	165.9	-75.3	-179	176.6	-165.3	-1.2	109.8
250	S	34.3	Very low	40.8	Very low	102 Å²	102	159.9 Å²	159.9	71%	0.713	77%	0.77	S	S	*	*				159.1	134.1	113.7	59.2	0	0	0	0	115
251	Y	31.8	Very low	39.7	Very low	204 Å²	204	161.5 Å²	161.5	80%	0.8	80%	0.798	S	S	*	*			trans	32.4	118.3	143.7	-67.2	-91.8	0	0	0	121.8
252	H	34.7	Very low	38.6	Very low	158 Å²	158	163.4 Å²	163.4	73%	0.731	81%	0.807	S	S	*	*				169.9	127.9	96.1	-102.6	-75.5	0	0	0	111.6
253	E	33.6	Very low	37.9	Very low	130 Å²	130	164.5 Å²	164.5	61%	0.607	81%	0.809	S	S	*	*				26.5	117.1	127.9	-173.6	174.3	-179.1	0	0	119.6
254	R	35.3	Very low	37.3	Very low	204 Å²	204	167.3 Å²	167.3	77%	0.77	82%	0.815	S	S	*	*				166.5	146	97.9	-121.4	152.4	-154	-164.6	11.2	112.1
255	K	37.6	Very low	36.6	Very low	196 Å²	196	170.3 Å²	170.3	85%	0.852	82%	0.819	S	S	*	*			trans	1.6	138.9	144.7	-78.6	177.1	175.1	175.4	0	115.7
256	S	40.8	Very low	36.3	Very low	99 Å²	99	165.8 Å²	165.8	69%	0.692	81%	0.813	S	S	*	*			cis	179.8	154.1	43	41.1	0	0	0	0	112.2
257	K	40.9	Very low	36.3	Very low	210 Å²	210	162.4 Å²	162.4	91%	0.913	81%	0.811	S	S	*	*			trans	63.5	132.3	139.9	-78.4	-176.7	174.4	-173.9	0	120.5
258	G	34.1	Very low	36.1	Very low	80 Å²	80	156.9 Å²	156.9	83%	0.825	80%	0.804	S	S	*	*			trans	-178.5	99.6	152.8	0	0	0	0	0	109.9
259	T	42.7	Very low	36.5	Very low	133 Å²	133	165.1 Å²	165.1	82%	0.816	83%	0.826	S	S	*	*			trans	-91.1	138	176.7	-60.4	0	0	0	0	110
260	E	36.3	Very low	36.8	Very low	185 Å²	185	159 Å²	159	86%	0.864	82%	0.82	S	S	*	*			trans	-178.1	123.6	144.1	-103.9	173.7	174.9	0	0	104.4
261	V	39.6	Very low	37	Very low	207 Å²	207	164.2 Å²	164.2	100%	1.255	83%	0.83	S	S	*	*			cis	-142.4	0	39.8	177.3	0	0	0	0	110.2

Retrieved 261 of 261 residues in 73.4 ms (Link to these results)

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