A0A077Z4N2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4N2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 234 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	26.8	Very low	23.9	Very low	243 Å²	243	156.4 Å²	156.4	100%	1.197	77%	0.774	S	S	*	*				0	114.2	0	-68.3	178	-179.3	0	0	108.8
2	P	27.8	Very low	23.8	Very low	125 Å²	125	155 Å²	155	81%	0.812	77%	0.772	S	S	*	*			trans	-125.8	116.5	160.8	25.8	-6.6	0	0	0	112.2
3	V	25.8	Very low	23.7	Very low	129 Å²	129	154.2 Å²	154.2	78%	0.782	77%	0.772	S	S	*	*			trans	44.1	102.1	139.1	-163.1	0	0	0	0	119	L5	V3-L5 PolarHBondContact O-N 2.82Å
4	R	21.7	Very low	23.6	Very low	212 Å²	212	152.4 Å²	152.4	80%	0.8	77%	0.773	S	S	*	*			trans	-74.8	104.7	162.6	-172.4	-171	-70.5	-166.4	-10.5	109.4	K6	R4-K6 HydrophobicContact CG-CG 4.2Å; R4-K6 PolarHBondContact O-N 2.8Å
5	L	24.1	Very low	23.7	Very low	136 Å²	136	150.3 Å²	150.3	71%	0.712	77%	0.77	S	S	*	*			trans	-86.8	90.4	165.4	-95.2	150.9	0	0	0	109.3	V3 H7	V3-L5 PolarHBondContact O-N 2.82Å; L5-H7 PolarHBondContact O-N 2.83Å; L5-H7 VanDerWaalsContact O-N 3.16Å
6	K	22.7	Very low	23.5	Very low	150 Å²	150	148.9 Å²	148.9	65%	0.652	77%	0.765	S	S	*	*			trans	-70.1	94.6	163.6	-79.7	-178.7	172.1	-177	0	108.1	R4 T8	R4-K6 HydrophobicContact CG-CG 4.2Å; R4-K6 PolarHBondContact O-N 2.8Å; K6-T8 VanDerWaalsContact C-N 3.29Å; K6-T8 PolarHBondContact O-N 3Å
7	H	24.5	Very low	23.5	Very low	149 Å²	149	144.6 Å²	144.6	69%	0.69	76%	0.757	S	S	*	*			trans	-89.9	78.6	156.6	-77.6	-67.7	0	0	0	108.5	L5 F9	L5-H7 PolarHBondContact O-N 2.83Å; L5-H7 VanDerWaalsContact O-N 3.16Å; H7-F9 PolarHBondContact O-N 3.18Å; H7-F9 VanDerWaalsContact O-N 3.11Å
8	T	22.1	Very low	23.4	Very low	121 Å²	121	143.7 Å²	143.7	74%	0.742	75%	0.753	S	S	*	*			trans	-63.4	98.3	160.1	32.1	0	0	0	0	107.9	K6 P10	K6-T8 VanDerWaalsContact C-N 3.29Å; K6-T8 PolarHBondContact O-N 3Å; T8-P10 WeakPolarHBondContact O-CD 3.34Å
9	F	22	Very low	23.4	Very low	164 Å²	164	143.9 Å²	143.9	72%	0.719	75%	0.75	S	S	*	*			trans	-74.2	121	163	-97.7	-86.8	0	0	0	108.4	H7 Y11	H7-F9 PolarHBondContact O-N 3.18Å; H7-F9 VanDerWaalsContact O-N 3.11Å; F9-Y11 HydrophobicContact CD1-CE2 4.32Å; F9-Y11 PolarHBondContact O-N 3.23Å; F9-Y11 VanDerWaalsContact O-N 3.13Å
10	P	22.4	Very low	23.4	Very low	104 Å²	104	144.9 Å²	144.9	68%	0.675	75%	0.748	S	S	*	*			trans	-84.7	83.9	178	34.3	-29.4	0	0	0	107.9	T8 N12	T8-P10 WeakPolarHBondContact O-CD 3.34Å; P10-N12 PolarHBondContact O-N 3.08Å; P10-N12 VanDerWaalsContact O-N 3.17Å
11	Y	23.3	Very low	23.3	Very low	187 Å²	187	145.7 Å²	145.7	73%	0.733	75%	0.748	S	S	*	*			trans	-87.4	73	160	-87.3	-80.1	0	0	0	108.7	F9 N13	F9-Y11 HydrophobicContact CD1-CE2 4.32Å; F9-Y11 PolarHBondContact O-N 3.23Å; F9-Y11 VanDerWaalsContact O-N 3.13Å; Y11-N13 PolarHBondContact O-N 2.92Å
12	N	22.8	Very low	23.3	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	71%	0.708	S	S	*	*			trans	-62.6	92.7	150.4	-85.3	-15.5	0	0	0	106.8	P10	P10-N12 PolarHBondContact O-N 3.08Å; P10-N12 VanDerWaalsContact O-N 3.17Å
13	N	21.9	Very low	23.2	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	70%	0.697	S	S	*	*			trans	-162.9	91	140.5	-89.8	-28.5	0	0	0	106.4	Y11 V15	Y11-N13 PolarHBondContact O-N 2.92Å; N13-V15 PolarHBondContact O-N 3Å
14	V	22.1	Very low	23.2	Very low	129 Å²	129	134 Å²	134	78%	0.782	68%	0.682	S	S	*	*			trans	-55.1	77.6	152.5	-177	0	0	0	0	107
15	V	25.5	Very low	23.5	Very low	120 Å²	120	125.2 Å²	125.2	73%	0.727	65%	0.653	S	S	*	*			trans	-93.6	108.5	137	-173.6	0	0	0	0	101	N13 A17	N13-V15 PolarHBondContact O-N 3Å; V15-A17 PolarHBondContact O-N 3.33Å
16	D	21.1	Very low	24	Very low	128 Å²	128	121.8 Å²	121.8	68%	0.684	64%	0.639	S	S	*	*			trans	-48.6	93.7	153.9	-74.6	-42.5	0	0	0	104.9	N18	D16-N18 PolarHBondContact O-N 2.94Å
17	A	22.9	Very low	24.6	Very low	77 Å²	77	117.8 Å²	117.8	64%	0.636	62%	0.624	S	S	*	*			trans	-55.7	80	137.2	0	0	0	0	0	102.8	V15 Q19	V15-A17 PolarHBondContact O-N 3.33Å; A17-Q19 PolarHBondContact O-N 2.85Å
18	N	22.6	Very low	24.9	Very low	128 Å²	128	111.6 Å²	111.6	68%	0.684	60%	0.598	S	S	*	*				-31.3	83.4	112.9	-81.2	-8.1	0	0	0	104.1	D16 F20	D16-N18 PolarHBondContact O-N 2.94Å; N18-F20 PolarHBondContact O-N 3.41Å
19	Q	21.9	Very low	25.5	Very low	148 Å²	148	113.4 Å²	113.4	69%	0.692	60%	0.596	S	S	*	*				9.9	87.4	120.8	-67.3	176	-33.3	0	0	104.8	A17 E21	A17-Q19 PolarHBondContact O-N 2.85Å; Q19-E21 HydrophobicContact CB-CG 4.18Å; Q19-E21 PolarHBondContact O-N 3.27Å
20	F	24.6	Very low	26.3	Very low	163 Å²	163	109.9 Å²	109.9	72%	0.715	58%	0.581	S	S	*	*			trans	-54.3	73.8	132.3	-57.9	-84.3	0	0	0	102.8	N18 Y22	N18-F20 PolarHBondContact O-N 3.41Å; F20-Y22 HydrophobicContact CB-CD1 4.44Å; F20-Y22 HydrophobicContact CB-CD2 4.35Å; F20-Y22 HydrophobicContact CB-CE1 4.14Å; F20-Y22 HydrophobicContact CB-CE2 4.01Å; F20-Y22 WeakPolarHBondContact O-CD2 3.28Å; F20-Y22 WeakPolarHBondContact O-CE2 3.49Å; F20-Y22 PolarHBondContact O-N 2.77Å
21	E	21.9	Very low	27.2	Very low	161 Å²	161	107.8 Å²	107.8	75%	0.752	56%	0.564	S	S	*	*			trans	-47.9	92	138	-88.9	178.6	160.7	0	0	99.8	Q19 A23	Q19-E21 HydrophobicContact CB-CG 4.18Å; Q19-E21 PolarHBondContact O-N 3.27Å; E21-A23 PolarHBondContact O-N 2.99Å
22	Y	24.9	Very low	27.9	Very low	92 Å²	92	99.4 Å²	99.4	36%	0.361	53%	0.532	S	S	.	.			trans	-60.4	86.4	166.2	-61.6	-88.6	0	0	0	101	F20 L24 Y92 L185	F20-Y22 HydrophobicContact CB-CD1 4.44Å; F20-Y22 HydrophobicContact CB-CD2 4.35Å; F20-Y22 HydrophobicContact CB-CE1 4.14Å; F20-Y22 HydrophobicContact CB-CE2 4.01Å; F20-Y22 WeakPolarHBondContact O-CD2 3.28Å; F20-Y22 WeakPolarHBondContact O-CE2 3.49Å; F20-Y22 PolarHBondContact O-N 2.77Å; Y22-L24 PolarHBondContact O-N 3Å; Y22-Y92 HydrophobicContact CD1-CE1 4.31Å; Y22-L185 HydrophobicContact CD1-CD2 4.06Å; Y22-L185 HydrophobicContact CE1-CD2 3.88Å
23	A	25.9	Very low	28.6	Very low	69 Å²	69	97.1 Å²	97.1	57%	0.57	52%	0.516	S	S	*	.			trans	-49.3	104.8	152.9	0	0	0	0	0	100.6	E21	E21-A23 PolarHBondContact O-N 2.99Å
24	L	25.9	Very low	29.4	Very low	91 Å²	91	91.5 Å²	91.5	48%	0.476	49%	0.489	S	S	.	.			trans	-26.4	120.9	141.5	-72.9	163.3	0	0	0	103.9	Y22 P26 F71	Y22-L24 PolarHBondContact O-N 3Å; L24-P26 WeakPolarHBondContact O-CA 3.47Å; L24-P26 WeakPolarHBondContact O-CD 3.45Å; L24-F71 HydrophobicContact CD2-CD1 4.3Å; L24-F71 HydrophobicContact CD2-CD2 3.2Å; L24-F71 HydrophobicContact CD2-CE1 4.25Å; L24-F71 HydrophobicContact CD2-CE2 3.18Å; L24-F71 HydrophobicContact CD2-CG 3.81Å; L24-F71 HydrophobicContact CD2-CZ 3.73Å; L24-F71 HydrophobicContact CG-CE2 4.46Å
25	P	28.6	Very low	29.9	Very low	27 Å²	27	87.8 Å²	87.8	18%	0.175	47%	0.468	C	S	.	.			trans	-47.8	104.8	169.5	25.6	-36.9	0	0	0	102.7	L27 T94 D183	P25-L27 PolarHBondContact O-N 2.96Å; P25-T94 HydrophobicContact CG-CG2 4.17Å; P25-D183 HydrophobicContact CB-CB 4.46Å; P25-D183 WeakPolarHBondContact CB-OD2 3.31Å; P25-D183 HydrophobicContact CG-CB 3.76Å; P25-D183 WeakPolarHBondContact CG-OD2 3.1Å
26	P	34.3	Very low	30.3	Very low	65 Å²	65	82.4 Å²	82.4	42%	0.422	44%	0.437	S	S	.	.			trans	-67	151	-174.7	15.5	-7.2	0	0	0	100.6	L24 A28 K29	L24-P26 WeakPolarHBondContact O-CA 3.47Å; L24-P26 WeakPolarHBondContact O-CD 3.45Å; P26-A28 HydrophobicContact CB-CB 3.91Å; P26-A28 HydrophobicContact CG-CB 4.16Å; P26-A28 CarbonylContact O-C 3.56Å; P26-A28 VanDerWaalsContact O-C 3.29Å; P26-A28 WeakPolarHBondContact O-CA 3.34Å; P26-A28 PolarHBondContact O-N 3.32Å; P26-K29 PolarHBondContact O-N 3.04Å
27	L	35.2	Very low	30.9	Very low	66 Å²	66	82.7 Å²	82.7	35%	0.346	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-41.1	-22	161.2	-66.7	143.1	0	0	0	110.9	P25 T97 N98	P25-L27 PolarHBondContact O-N 2.96Å; L27-T97 VanDerWaalsContact CD2-O 3.23Å; L27-T97 WeakPolarHBondContact CD2-O 3.47Å; L27-N98 HydrophobicContact CD2-CB 4.24Å; L27-N98 VanDerWaalsContact CD2-OD1 3.3Å; L27-N98 WeakPolarHBondContact CD2-OD1 3.47Å
28	A	31.2	Very low	31.3	Very low	18 Å²	18	86 Å²	86	15%	0.149	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-85.3	32.4	164.4	0	0	0	0	0	119.7	P26 F30 N31	P26-A28 HydrophobicContact CB-CB 3.91Å; P26-A28 HydrophobicContact CG-CB 4.16Å; P26-A28 CarbonylContact O-C 3.56Å; P26-A28 VanDerWaalsContact O-C 3.29Å; P26-A28 WeakPolarHBondContact O-CA 3.34Å; P26-A28 PolarHBondContact O-N 3.32Å; A28-F30 CarbonylContact C-O 3.55Å; A28-F30 VanDerWaalsContact CA-O 3.3Å; A28-F30 WeakPolarHBondContact CA-O 3.36Å; A28-F30 CarbonylContact O-C 3.36Å; A28-N31 VanDerWaalsContact C-N 3.27Å; A28-N31 HydrophobicContact CB-CB 3.91Å; A28-N31 WeakPolarHBondContact O-CA 3.41Å; A28-N31 WeakPolarHBondContact O-CB 3.07Å; A28-N31 PolarHBondContact O-N 3.25Å
29	K	34.8	Very low	31.8	Very low	159 Å²	159	81 Å²	81	69%	0.691	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-68.2	-28	160.8	-156.3	-179.2	-175.7	-178.1	0	110.3	P26 N31	P26-K29 PolarHBondContact O-N 3.04Å; K29-N31 PolarHBondContact O-N 3.23Å
30	F	38.1	Very low	32.3	Very low	91 Å²	91	75.2 Å²	75.2	40%	0.399	39%	0.39	S	S	.	.	S	Bend	trans	-81.3	77.7	144	-96.5	-96.9	0	0	0	107.1	A28 P32 W101	A28-F30 CarbonylContact C-O 3.55Å; A28-F30 VanDerWaalsContact CA-O 3.3Å; A28-F30 WeakPolarHBondContact CA-O 3.36Å; A28-F30 CarbonylContact O-C 3.36Å; F30-P32 WeakPolarHBondContact O-CD 3.4Å; F30-W101 HydrophobicContact CB-CZ2 4.03Å; F30-W101 AromaticContact CD1-CH2 3.89Å; F30-W101 HydrophobicContact CD1-CH2 3.89Å; F30-W101 AromaticContact CD1-CZ2 3.92Å; F30-W101 HydrophobicContact CD1-CZ2 3.92Å; F30-W101 HydrophobicContact CG-CZ2 4.18Å
31	N	41	Very low	32.8	Very low	59 Å²	59	72.7 Å²	72.7	32%	0.316	39%	0.39	S	S	.	.			trans	-73.4	106.5	170.5	-173.3	-10.7	0	0	0	103.4	A28 K29 F33 A34	A28-N31 VanDerWaalsContact C-N 3.27Å; A28-N31 HydrophobicContact CB-CB 3.91Å; A28-N31 WeakPolarHBondContact O-CA 3.41Å; A28-N31 WeakPolarHBondContact O-CB 3.07Å; A28-N31 PolarHBondContact O-N 3.25Å; K29-N31 PolarHBondContact O-N 3.23Å; N31-F33 PolarHBondContact O-N 3.21Å; N31-F33 VanDerWaalsContact OD1-CB 3.3Å; N31-F33 WeakPolarHBondContact OD1-CB 3.45Å; N31-F33 WeakPolarHBondContact OD1-CD2 3.21Å; N31-F33 PolarHBondContact OD1-N 3.4Å; N31-F33 VanDerWaalsContact OD1-N 3.1Å; N31-A34 HydrophobicContact CB-CB 3.4Å; N31-A34 PolarHBondContact O-N 3.02Å; N31-A34 PolarHBondContact OD1-N 3.39Å
32	P	39.2	Very low	33.4	Very low	12 Å²	12	74.3 Å²	74.3	8%	0.078	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-12.1	-179.8	28.4	-33.5	0	0	0	111	F30 W101 S103	F30-P32 WeakPolarHBondContact O-CD 3.4Å; P32-W101 HydrophobicContact CB-CD2 4.22Å; P32-W101 HydrophobicContact CB-CE3 3.63Å; P32-W101 HydrophobicContact CB-CZ3 4.06Å; P32-W101 HydrophobicContact CG-CB 4.25Å; P32-W101 HydrophobicContact CG-CD2 4.34Å; P32-W101 HydrophobicContact CG-CE3 4.2Å; P32-W101 HydrophobicContact CG-CG 4.39Å; P32-S103 PolarHBondContact O-OG 3.02Å; P32-S103 VanDerWaalsContact O-OG 3.08Å
33	F	37.9	Very low	33.9	Very low	92 Å²	92	75.6 Å²	75.6	40%	0.404	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-9.1	175.3	-49.4	-88.6	0	0	0	115.3	N31 P35 G61	N31-F33 PolarHBondContact O-N 3.21Å; N31-F33 VanDerWaalsContact OD1-CB 3.3Å; N31-F33 WeakPolarHBondContact OD1-CB 3.45Å; N31-F33 WeakPolarHBondContact OD1-CD2 3.21Å; N31-F33 PolarHBondContact OD1-N 3.4Å; N31-F33 VanDerWaalsContact OD1-N 3.1Å; F33-P35 WeakPolarHBondContact O-CD 3.36Å; F33-G61 WeakPolarHBondContact CE1-O 3.3Å; F33-G61 WeakPolarHBondContact CZ-O 3.43Å
34	A	38.8	Very low	34.2	Very low	26 Å²	26	76.3 Å²	76.3	22%	0.215	40%	0.399	C	S	.	.			trans	-80.8	112	173.9	0	0	0	0	0	105.8	N31 G36 T37	N31-A34 HydrophobicContact CB-CB 3.4Å; N31-A34 PolarHBondContact O-N 3.02Å; N31-A34 PolarHBondContact OD1-N 3.39Å; A34-G36 PolarHBondContact O-N 2.87Å; A34-T37 HydrophobicContact CB-CG2 4.16Å
35	P	31.7	Very low	34.7	Very low	52 Å²	52	75.2 Å²	75.2	34%	0.338	41%	0.41	S	S	.	.	S	Bend	trans	-68.3	74.2	155.2	37.3	-41	0	0	0	106.2	F33 F49	F33-P35 WeakPolarHBondContact O-CD 3.36Å; P35-F49 HydrophobicContact CB-CE1 4.17Å; P35-F49 HydrophobicContact CB-CE2 3.57Å; P35-F49 HydrophobicContact CB-CZ 3.29Å; P35-F49 HydrophobicContact CG-CD2 4.34Å; P35-F49 HydrophobicContact CG-CE2 3.34Å; P35-F49 HydrophobicContact CG-CZ 3.65Å; P35-F49 WeakPolarHBondContact O-CZ 3.33Å
36	G	33.5	Very low	34.8	Very low	7 Å²	7	80 Å²	80	7%	0.072	44%	0.439	C	S	.	.			trans	53.6	120.3	-172.3	0	0	0	0	0	114.3	A34 K38 P39 R146	A34-G36 PolarHBondContact O-N 2.87Å; G36-K38 CarbonylContact O-C 3.57Å; G36-K38 VanDerWaalsContact O-C 3.31Å; G36-K38 PolarHBondContact O-N 3.31Å; G36-P39 WeakPolarHBondContact O-CD 3.49Å; G36-R146 VanDerWaalsContact CA-NH1 3.26Å
37	T	34.3	Very low	35	Very low	133 Å²	133	81.5 Å²	81.5	82%	0.816	44%	0.44	S	S	*	.	S	Bend	trans	-56.7	-4.3	164.2	40.1	0	0	0	0	114	A34	A34-T37 HydrophobicContact CB-CG2 4.16Å
38	K	32.2	Very low	35.1	Very low	147 Å²	147	83.4 Å²	83.4	64%	0.639	45%	0.45	S	S	*	.	S	Bend	trans	-136.7	98.6	155.3	-59.1	-177.9	-177.1	-178.3	0	106.3	G36 F40	G36-K38 CarbonylContact O-C 3.57Å; G36-K38 VanDerWaalsContact O-C 3.31Å; G36-K38 PolarHBondContact O-N 3.31Å; K38-F40 PolarHBondContact O-N 2.94Å; K38-F40 VanDerWaalsContact O-N 3.14Å
39	P	31.1	Very low	35.5	Very low	22 Å²	22	84.2 Å²	84.2	14%	0.143	45%	0.45	C	S	.	.	S	Bend	trans	-51.8	-35.9	171.8	-28.5	37.7	0	0	0	110	G36 F49	G36-P39 WeakPolarHBondContact O-CD 3.49Å; P39-F49 HydrophobicContact CB-CD2 4.47Å; P39-F49 HydrophobicContact CB-CE1 3.86Å; P39-F49 HydrophobicContact CB-CE2 3.76Å; P39-F49 HydrophobicContact CB-CZ 3.38Å; P39-F49 HydrophobicContact CG-CD2 4.31Å; P39-F49 HydrophobicContact CG-CE1 4.48Å; P39-F49 HydrophobicContact CG-CE2 3.47Å; P39-F49 VanDerWaalsContact CG-CE2 3.47Å; P39-F49 HydrophobicContact CG-CZ 3.55Å
40	F	34.3	Very low	36	Very low	28 Å²	28	78.1 Å²	78.1	12%	0.123	43%	0.427	C	S	.	.	S	Bend	trans	-143.2	151.6	168.2	-65.4	-69.1	0	0	0	110.1	K38 Q42 R43 P50 V142 S143	K38-F40 PolarHBondContact O-N 2.94Å; K38-F40 VanDerWaalsContact O-N 3.14Å; F40-Q42 PolarHBondContact O-N 3.46Å; F40-Q42 VanDerWaalsContact O-N 3.12Å; F40-R43 HydrophobicContact CB-CB 4.44Å; F40-R43 HydrophobicContact CB-CG 4.42Å; F40-R43 PolarHBondContact O-N 3.03Å; F40-R43 VanDerWaalsContact O-N 3.15Å; F40-P50 HydrophobicContact CE2-CG 4.14Å; F40-V142 HydrophobicContact CD1-CB 4.44Å; F40-V142 HydrophobicContact CD1-CG1 3.64Å; F40-V142 HydrophobicContact CD2-CG1 3.78Å; F40-V142 HydrophobicContact CE1-CB 4.09Å; F40-V142 HydrophobicContact CE1-CG1 3.24Å; F40-V142 HydrophobicContact CE2-CG1 3.36Å; F40-V142 HydrophobicContact CG-CG1 3.94Å; F40-V142 HydrophobicContact CZ-CB 4.32Å; F40-V142 HydrophobicContact CZ-CG1 3.12Å; F40-S143 VanDerWaalsContact CE1-N 3.34Å; F40-S143 VanDerWaalsContact CE1-OG 3.28Å; F40-S143 WeakPolarHBondContact CE1-OG 3.5Å; F40-S143 WeakPolarHBondContact CZ-O 3.42Å; F40-S143 VanDerWaalsContact CZ-OG 3.25Å; F40-S143 WeakPolarHBondContact CZ-OG 3.31Å
41	P	33.2	Very low	36.5	Very low	109 Å²	109	80.2 Å²	80.2	71%	0.708	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	124.5	166.6	-19.5	29.6	0	0	0	108.3
42	Q	35.1	Very low	37.3	Very low	195 Å²	195	77.6 Å²	77.6	91%	0.911	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	13.5	178.4	-48.1	178.3	-7.1	0	0	118.4	F40	F40-Q42 PolarHBondContact O-N 3.46Å; F40-Q42 VanDerWaalsContact O-N 3.12Å
43	R	36.6	Very low	38.4	Very low	120 Å²	120	78.1 Å²	78.1	45%	0.453	43%	0.427	S	S	.	.			trans	-115.9	131.4	173.4	-67.8	-152.7	159.1	160.5	-2	114.3	F40 E47	F40-R43 HydrophobicContact CB-CB 4.44Å; F40-R43 HydrophobicContact CB-CG 4.42Å; F40-R43 PolarHBondContact O-N 3.03Å; F40-R43 VanDerWaalsContact O-N 3.15Å; R43-E47 WeakPolarHBondContact CA-OE2 3.47Å; R43-E47 WeakPolarHBondContact CB-OE2 3.48Å; R43-E47 WeakPolarHBondContact CD-OE2 3.31Å; R43-E47 WeakPolarHBondContact CG-OE2 3.47Å; R43-E47 IonicContact NE-OE2 3.57Å; R43-E47 PolarHBondContact NE-OE2 3.13Å
44	T	32.1	Very low	39.8	Very low	83 Å²	83	73.9 Å²	73.9	51%	0.509	41%	0.409	S	S	.	.			trans	-81.5	149.6	174.8	51.5	0	0	0	0	111.3	V46 E47	T44-V46 PolarHBondContact O-N 3.07Å; T44-V46 WeakPolarHBondContact OG1-CG2 3.26Å; T44-E47 WeakPolarHBondContact O-CA 3.49Å; T44-E47 WeakPolarHBondContact O-CB 3.09Å; T44-E47 PolarHBondContact O-N 2.91Å
45	G	34.8	Very low	41.1	Very low	69 Å²	69	73.1 Å²	73.1	71%	0.711	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.1	-179.3	0	0	0	0	0	116.3
46	V	32.2	Very low	42.9	Very low	128 Å²	128	74 Å²	74	78%	0.776	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-25.3	169.7	-87.7	0	0	0	0	112.8	T44 L48	T44-V46 PolarHBondContact O-N 3.07Å; T44-V46 WeakPolarHBondContact OG1-CG2 3.26Å; V46-L48 PolarHBondContact O-N 3.25Å
47	E	37	Very low	44.6	Very low	96 Å²	96	76.9 Å²	76.9	45%	0.449	41%	0.413	S	S	.	.	S	Bend	trans	-73.2	91.5	159.1	-63.9	-178.9	153.6	0	0	105	R43 T44 F49	R43-E47 WeakPolarHBondContact CA-OE2 3.47Å; R43-E47 WeakPolarHBondContact CB-OE2 3.48Å; R43-E47 WeakPolarHBondContact CD-OE2 3.31Å; R43-E47 WeakPolarHBondContact CG-OE2 3.47Å; R43-E47 IonicContact NE-OE2 3.57Å; R43-E47 PolarHBondContact NE-OE2 3.13Å; T44-E47 WeakPolarHBondContact O-CA 3.49Å; T44-E47 WeakPolarHBondContact O-CB 3.09Å; T44-E47 PolarHBondContact O-N 2.91Å; E47-F49 PolarHBondContact O-N 3.46Å; E47-F49 VanDerWaalsContact O-N 3.13Å
48	L	37.8	Very low	46.1	Very low	106 Å²	106	75.2 Å²	75.2	56%	0.555	39%	0.394	S	S	*	.			trans	-26.5	123.7	170.4	-100.9	65.1	0	0	0	108.3	V46 Q51	V46-L48 PolarHBondContact O-N 3.25Å; L48-Q51 HydrophobicContact CD2-CG 4Å; L48-Q51 HydrophobicContact CG-CG 4.43Å
49	F	39.7	Very low	47.5	Very low	35 Å²	35	70.6 Å²	70.6	15%	0.154	38%	0.384	C	S	.	.			trans	-26.4	119.4	153.1	-100.5	-89.6	0	0	0	106.6	P35 P39 E47 Q51	P35-F49 HydrophobicContact CB-CE1 4.17Å; P35-F49 HydrophobicContact CB-CE2 3.57Å; P35-F49 HydrophobicContact CB-CZ 3.29Å; P35-F49 HydrophobicContact CG-CD2 4.34Å; P35-F49 HydrophobicContact CG-CE2 3.34Å; P35-F49 HydrophobicContact CG-CZ 3.65Å; P35-F49 WeakPolarHBondContact O-CZ 3.33Å; P39-F49 HydrophobicContact CB-CD2 4.47Å; P39-F49 HydrophobicContact CB-CE1 3.86Å; P39-F49 HydrophobicContact CB-CE2 3.76Å; P39-F49 HydrophobicContact CB-CZ 3.38Å; P39-F49 HydrophobicContact CG-CD2 4.31Å; P39-F49 HydrophobicContact CG-CE1 4.48Å; P39-F49 HydrophobicContact CG-CE2 3.47Å; P39-F49 VanDerWaalsContact CG-CE2 3.47Å; P39-F49 HydrophobicContact CG-CZ 3.55Å; E47-F49 PolarHBondContact O-N 3.46Å; E47-F49 VanDerWaalsContact O-N 3.13Å; F49-Q51 WeakPolarHBondContact O-CA 3.36Å; F49-Q51 WeakPolarHBondContact O-CG 3.21Å; F49-Q51 PolarHBondContact O-N 2.93Å
50	P	45.1	Very low	48.9	Very low	30 Å²	30	72.7 Å²	72.7	20%	0.195	39%	0.394	C	S	.	.			trans	-51.7	103.1	-175.1	18.6	-29.4	0	0	0	105.2	F40 F52 V142	F40-P50 HydrophobicContact CE2-CG 4.14Å; P50-F52 HydrophobicContact CB-CE2 4.25Å; P50-F52 HydrophobicContact CG-CE2 4.02Å; P50-F52 VanDerWaalsContact O-CD2 3.23Å; P50-F52 WeakPolarHBondContact O-CD2 3.17Å; P50-F52 PolarHBondContact O-N 2.94Å; P50-V142 HydrophobicContact CG-CG1 4.06Å
51	Q	49.5	Very low	49.8	Very low	135 Å²	135	72.2 Å²	72.2	63%	0.631	40%	0.397	S	S	*	.			trans	-76.5	92.1	-170.9	-80.2	-171.3	2.7	0	0	100	L48 F49 P53	L48-Q51 HydrophobicContact CD2-CG 4Å; L48-Q51 HydrophobicContact CG-CG 4.43Å; F49-Q51 WeakPolarHBondContact O-CA 3.36Å; F49-Q51 WeakPolarHBondContact O-CG 3.21Å; F49-Q51 PolarHBondContact O-N 2.93Å; Q51-P53 WeakPolarHBondContact O-CD 3.27Å
52	F	58.6	Low	51.1	Low	5 Å²	5	72.4 Å²	72.4	2%	0.022	39%	0.39	C	S	.	.			trans	-61.9	111.9	174.3	-76.7	-78	0	0	0	103.3	P50 L54 S55 V144 C156 C161	P50-F52 HydrophobicContact CB-CE2 4.25Å; P50-F52 HydrophobicContact CG-CE2 4.02Å; P50-F52 VanDerWaalsContact O-CD2 3.23Å; P50-F52 WeakPolarHBondContact O-CD2 3.17Å; P50-F52 PolarHBondContact O-N 2.94Å; F52-L54 PolarHBondContact O-N 3.16Å; F52-S55 VanDerWaalsContact CB-OG 3.22Å; F52-S55 WeakPolarHBondContact CB-OG 3.28Å; F52-S55 PolarHBondContact O-N 3.3Å; F52-S55 PolarHBondContact O-OG 3.36Å; F52-V144 HydrophobicContact CB-CG1 4.47Å; F52-V144 HydrophobicContact CD2-CB 4.15Å; F52-V144 HydrophobicContact CD2-CG1 3.75Å; F52-V144 HydrophobicContact CD2-CG2 4.06Å; F52-V144 HydrophobicContact CE2-CB 4.21Å; F52-V144 HydrophobicContact CE2-CG1 4.32Å; F52-V144 HydrophobicContact CE2-CG2 3.86Å; F52-V144 HydrophobicContact CG-CG1 4.33Å; F52-V144 HydrophobicContact CZ-CG2 4.32Å; F52-C156 HydrophobicContact CE1-CB 4.04Å; F52-C156 HydrophobicContact CZ-CB 3.94Å; F52-C161 HydrophobicContact CD1-CB 4.41Å
53	P	61.4	Low	52	Low	22 Å²	22	66.7 Å²	66.7	14%	0.143	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.2	-165.9	22.6	-32.9	0	0	0	112.8	Q51 M113 L114 I160	Q51-P53 WeakPolarHBondContact O-CD 3.27Å; P53-M113 PolarHBondContact O-N 2.98Å; P53-L114 HydrophobicContact CB-CD1 3.29Å; P53-L114 HydrophobicContact CB-CG 3.6Å; P53-L114 HydrophobicContact CG-CD1 4.04Å; P53-I160 HydrophobicContact CG-CD1 3.85Å; P53-I160 HydrophobicContact CG-CG1 3.95Å
54	L	67.7	Low	52.7	Low	4 Å²	4	70.8 Å²	70.8	2%	0.021	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	11.9	-177	-53.3	177.3	0	0	0	114.2	F52 P110 V111 I121 I160 P163	F52-L54 PolarHBondContact O-N 3.16Å; L54-P110 WeakPolarHBondContact O-CA 3.42Å; L54-V111 CarbonylContact C-O 3.49Å; L54-V111 WeakPolarHBondContact CA-O 3.32Å; L54-V111 PolarHBondContact O-N 3.42Å; L54-I121 HydrophobicContact CD1-CG2 4.28Å; L54-I121 HydrophobicContact CD2-CD1 4.27Å; L54-I160 HydrophobicContact CD1-CG2 4.02Å; L54-P163 HydrophobicContact CD1-CB 3.71Å; L54-P163 HydrophobicContact CD1-CG 4.27Å
55	S	65.6	Low	53.6	Low	9 Å²	9	69.8 Å²	69.8	6%	0.063	39%	0.386	C	S	.	.			trans	-131.1	136.1	173.5	59.4	0	0	0	0	111.6	F52 M113 V144	F52-S55 VanDerWaalsContact CB-OG 3.22Å; F52-S55 WeakPolarHBondContact CB-OG 3.28Å; F52-S55 PolarHBondContact O-N 3.3Å; F52-S55 PolarHBondContact O-OG 3.36Å; S55-M113 WeakPolarHBondContact O-CE 3.33Å; S55-V144 WeakPolarHBondContact OG-CG1 3.25Å
56	H	70	Confident	54.4	Low	72 Å²	72	71.2 Å²	71.2	33%	0.333	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.5	172.2	-176.8	-83	0	0	0	108.7	H106 L107 V108 V111 M113	H56-H106 AromaticContact CE1-NE2 3.83Å; H56-H106 AromaticContact ND1-NE2 3.8Å; H56-L107 WeakPolarHBondContact O-CA 3.33Å; H56-L107 WeakPolarHBondContact O-CD1 3.22Å; H56-V108 PolarHBondContact N-O 2.89Å; H56-V108 PolarHBondContact O-N 2.88Å; H56-V111 HydrophobicContact CB-CB 4.34Å; H56-V111 HydrophobicContact CB-CG1 3.8Å; H56-V111 HydrophobicContact CB-CG2 3.79Å; H56-M113 VanDerWaalsContact CA-CE 3.44Å; H56-M113 HydrophobicContact CB-CE 3.54Å; H56-M113 VanDerWaalsContact CD2-CE 3.43Å; H56-M113 WeakPolarHBondContact CD2-CE 3.39Å
57	Q	67.9	Low	55.4	Low	67 Å²	67	66.1 Å²	66.1	31%	0.313	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143.4	171.7	64.4	172.3	3	0	0	109.5	L107 V144 A145	Q57-L107 HydrophobicContact CB-CD1 4.19Å; Q57-V144 PolarHBondContact OE1-O 2.73Å; Q57-A145 HydrophobicContact CB-CB 4.07Å
58	F	67.1	Low	56.1	Low	98 Å²	98	63.7 Å²	63.7	43%	0.43	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	123.9	173.4	179.3	-102.2	0	0	0	107.9	N60 Y104 G105 H106	F58-N60 VanDerWaalsContact CD1-ND2 3.26Å; F58-N60 WeakPolarHBondContact CD1-ND2 3.4Å; F58-N60 WeakPolarHBondContact CD2-ND2 3.35Å; F58-N60 WeakPolarHBondContact CE1-ND2 3.45Å; F58-N60 WeakPolarHBondContact CE2-ND2 3.21Å; F58-N60 WeakPolarHBondContact CZ-ND2 2.81Å; F58-Y104 HydrophobicContact CD1-CD1 4.34Å; F58-Y104 HydrophobicContact CD1-CE1 4.07Å; F58-Y104 HydrophobicContact CE1-CD1 4.35Å; F58-Y104 HydrophobicContact CE1-CE1 4.24Å; F58-G105 CarbonylContact O-C 3.34Å; F58-G105 WeakPolarHBondContact O-CA 3.44Å; F58-H106 WeakPolarHBondContact CB-CE1 3.19Å; F58-H106 AromaticContact CD1-CE1 3.36Å; F58-H106 WeakPolarHBondContact CD1-CE1 3.34Å; F58-H106 AromaticContact CD1-ND1 3.68Å; F58-H106 AromaticContact CG-CE1 3.69Å; F58-H106 PolarHBondContact N-O 2.57Å; F58-H106 PolarHBondContact O-N 2.72Å
59	A	60.5	Low	57.1	Low	50 Å²	50	61.5 Å²	61.5	41%	0.413	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.3	177.3	0	0	0	0	0	108.2	Y104	A59-Y104 WeakPolarHBondContact CA-O 3.22Å
60	N	60.6	Low	58	Low	66 Å²	66	65 Å²	65	35%	0.353	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	162	177.9	-69	-95	0	0	0	109.6	F58 S103 Y104	F58-N60 VanDerWaalsContact CD1-ND2 3.26Å; F58-N60 WeakPolarHBondContact CD1-ND2 3.4Å; F58-N60 WeakPolarHBondContact CD2-ND2 3.35Å; F58-N60 WeakPolarHBondContact CE1-ND2 3.45Å; F58-N60 WeakPolarHBondContact CE2-ND2 3.21Å; F58-N60 WeakPolarHBondContact CZ-ND2 2.81Å; N60-S103 WeakPolarHBondContact O-CA 3.23Å; N60-S103 PolarHBondContact O-OG 2.91Å; N60-Y104 PolarHBondContact N-O 2.95Å; N60-Y104 PolarHBondContact O-N 3.25Å
61	G	54.5	Low	58.6	Low	18 Å²	18	68.3 Å²	68.3	19%	0.186	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	179.8	167.7	0	0	0	0	0	111.7	F33 Y102	F33-G61 WeakPolarHBondContact CE1-O 3.3Å; F33-G61 WeakPolarHBondContact CZ-O 3.43Å; G61-Y102 CarbonylContact C-O 3.6Å; G61-Y102 WeakPolarHBondContact CA-O 3.28Å
62	I	59.3	Low	58.9	Low	113 Å²	113	67.2 Å²	67.2	58%	0.579	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.8	131.8	161.7	-172.7	167.2	0	0	0	106.8	W101 Y102	I62-W101 CarbonylContact O-C 3.52Å; I62-W101 VanDerWaalsContact O-CA 3.3Å; I62-W101 WeakPolarHBondContact O-CA 3.16Å; I62-Y102 HydrophobicContact CG2-CD1 4.23Å; I62-Y102 PolarHBondContact N-O 2.92Å; I62-Y102 PolarHBondContact O-N 3.49Å
63	E	54	Low	58.7	Low	74 Å²	74	73.7 Å²	73.7	35%	0.346	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.1	175.4	-176.2	176.3	167.6	0	0	107.6	A99 W101	E63-A99 HydrophobicContact CG-CB 3.95Å; E63-A99 WeakPolarHBondContact OE1-CB 3Å; E63-W101 HydrophobicContact CB-CB 4.22Å; E63-W101 HydrophobicContact CG-CB 4.26Å
64	R	51.5	Low	58.5	Low	206 Å²	206	75.7 Å²	75.7	78%	0.777	44%	0.442	S	S	*	.			trans	-122	119.4	-177.1	-176.4	-173.2	-177.6	-140.5	0.6	110.8	P100	R64-P100 PolarHBondContact N-O 3.04Å; R64-P100 WeakPolarHBondContact O-CD 3.25Å; R64-P100 WeakPolarHBondContact O-CG 3.47Å
65	G	51.9	Low	57.9	Low	63 Å²	63	79.7 Å²	79.7	65%	0.649	46%	0.463	S	S	*	.	S	Bend	trans	96.7	179	170.9	0	0	0	0	0	113.5
66	A	51.6	Low	57.9	Low	99 Å²	99	83.9 Å²	83.9	82%	0.818	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-102.3	123.8	176	0	0	0	0	0	109.1
67	G	52.4	Low	57.7	Low	20 Å²	20	84.3 Å²	84.3	21%	0.206	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-62.5	136.6	160.3	0	0	0	0	0	108.9	T97	G67-T97 WeakPolarHBondContact CA-O 3.5Å
68	G	51	Low	57.7	Low	45 Å²	45	83.7 Å²	83.7	46%	0.464	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-96.8	132.4	176	0	0	0	0	0	109.5	G96 T97	G68-G96 CarbonylContact O-C 3.43Å; G68-G96 WeakPolarHBondContact O-CA 3.25Å; G68-T97 PolarHBondContact N-OG1 3.21Å; G68-T97 PolarHBondContact O-N 3.09Å; G68-T97 PolarHBondContact O-OG1 3.45Å
69	G	60.2	Low	57.7	Low	61 Å²	61	83.5 Å²	83.5	63%	0.629	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-158.7	148.4	178.3	0	0	0	0	0	114	S95	G69-S95 CarbonylContact C-O 3.33Å; G69-S95 WeakPolarHBondContact CA-O 3.48Å
70	L	58.3	Low	57.9	Low	109 Å²	109	83 Å²	83	57%	0.571	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.4	167.4	-177.7	66.7	0	0	0	108.7	M72 T94 S95	L70-M72 HydrophobicContact CD1-CG 4.3Å; L70-M72 HydrophobicContact CD2-CG 4.07Å; L70-M72 HydrophobicContact CD2-SD 3.91Å; L70-M72 HydrophobicContact CG-CG 3.95Å; L70-M72 HydrophobicContact CG-SD 4.45Å; L70-T94 WeakPolarHBondContact O-CA 2.93Å; L70-S95 PolarHBondContact N-O 2.85Å; L70-S95 PolarHBondContact O-N 3.25Å
71	F	56.6	Low	58.1	Low	98 Å²	98	85.8 Å²	85.8	43%	0.43	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.8	170.7	178.9	-106.9	0	0	0	108.9	L24 K73 Y92 T94	L24-F71 HydrophobicContact CD2-CD1 4.3Å; L24-F71 HydrophobicContact CD2-CD2 3.2Å; L24-F71 HydrophobicContact CD2-CE1 4.25Å; L24-F71 HydrophobicContact CD2-CE2 3.18Å; L24-F71 HydrophobicContact CD2-CG 3.81Å; L24-F71 HydrophobicContact CD2-CZ 3.73Å; L24-F71 HydrophobicContact CG-CE2 4.46Å; F71-K73 HydrophobicContact CE1-CB 3.71Å; F71-K73 HydrophobicContact CE1-CD 4.36Å; F71-K73 HydrophobicContact CZ-CB 3.89Å; F71-K73 HydrophobicContact CZ-CD 4.32Å; F71-K73 HydrophobicContact CZ-CG 4.49Å; F71-Y92 HydrophobicContact CE2-CD2 4.37Å; F71-Y92 HydrophobicContact CE2-CG 4.33Å; F71-T94 HydrophobicContact CD2-CG2 3.46Å; F71-T94 VanDerWaalsContact CD2-CG2 3.46Å; F71-T94 HydrophobicContact CE2-CG2 3.73Å
72	M	56.7	Low	58.7	Low	113 Å²	113	95.7 Å²	95.7	56%	0.557	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.9	173.5	-61.6	-174.7	80.6	0	0	108.8	L70 Y92 L93	L70-M72 HydrophobicContact CD1-CG 4.3Å; L70-M72 HydrophobicContact CD2-CG 4.07Å; L70-M72 HydrophobicContact CD2-SD 3.91Å; L70-M72 HydrophobicContact CG-CG 3.95Å; L70-M72 HydrophobicContact CG-SD 4.45Å; M72-Y92 CarbonylContact O-C 3.4Å; M72-Y92 VanDerWaalsContact O-CA 3.26Å; M72-Y92 WeakPolarHBondContact O-CA 3.11Å; M72-L93 PolarHBondContact N-O 3.42Å; M72-L93 PolarHBondContact O-N 3.23Å
73	K	54.4	Low	58.6	Low	141 Å²	141	94.9 Å²	94.9	61%	0.613	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.6	173.9	-176	177.4	-179.9	176.8	0	108.9	F71	F71-K73 HydrophobicContact CE1-CB 3.71Å; F71-K73 HydrophobicContact CE1-CD 4.36Å; F71-K73 HydrophobicContact CZ-CB 3.89Å; F71-K73 HydrophobicContact CZ-CD 4.32Å; F71-K73 HydrophobicContact CZ-CG 4.49Å
74	A	55.8	Low	58.8	Low	64 Å²	64	99.6 Å²	99.6	53%	0.529	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.5	134.9	174.7	0	0	0	0	0	109.1	G91	A74-G91 PolarHBondContact N-O 3.36Å; A74-G91 PolarHBondContact O-N 3.14Å
75	N	56.2	Low	59.1	Low	87 Å²	87	91.4 Å²	91.4	47%	0.465	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	125.2	167.7	-169.3	26.2	0	0	0	108.2	N77 D88 I89 K90	N75-N77 PolarHBondContact ND2-OD1 3.2Å; N75-N77 PolarHBondContact OD1-OD1 3.07Å; N75-N77 VanDerWaalsContact OD1-OD1 3.09Å; N75-D88 PolarHBondContact OD1-OD1 3.12Å; N75-I89 WeakPolarHBondContact CA-O 3.11Å; N75-I89 PolarHBondContact OD1-O 2.9Å; N75-K90 WeakPolarHBondContact OD1-CG 3.39Å
76	L	65.7	Low	59.6	Low	97 Å²	97	92.4 Å²	92.4	51%	0.508	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.2	179.9	177.2	64.8	0	0	0	109.1	V78 I89	L76-V78 HydrophobicContact CD1-CG2 4.12Å; L76-V78 HydrophobicContact CD2-CG2 4.27Å; L76-V78 HydrophobicContact CG-CG2 3.97Å; L76-I89 HydrophobicContact CB-CB 4.38Å; L76-I89 HydrophobicContact CD2-CD1 4.4Å; L76-I89 PolarHBondContact N-O 3.1Å; L76-I89 PolarHBondContact O-N 3.41Å
77	N	65.3	Low	60.1	Low	81 Å²	81	91.9 Å²	91.9	43%	0.433	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	105	-180	-67.7	40.9	0	0	0	108.8	N75 V86 W87 D88	N75-N77 PolarHBondContact ND2-OD1 3.2Å; N75-N77 PolarHBondContact OD1-OD1 3.07Å; N75-N77 VanDerWaalsContact OD1-OD1 3.09Å; N77-V86 HydrophobicContact CB-CG1 3.94Å; N77-W87 CarbonylContact C-O 3.31Å; N77-W87 VanDerWaalsContact CA-O 3.31Å; N77-W87 WeakPolarHBondContact CA-O 3.45Å; N77-D88 PolarHBondContact ND2-OD1 2.79Å; N77-D88 PolarHBondContact OD1-OD1 2.81Å
78	V	67.8	Low	60.5	Low	54 Å²	54	91.7 Å²	91.7	33%	0.327	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	112.2	177	-174.6	0	0	0	0	109	L76 I80 W87	L76-V78 HydrophobicContact CD1-CG2 4.12Å; L76-V78 HydrophobicContact CD2-CG2 4.27Å; L76-V78 HydrophobicContact CG-CG2 3.97Å; V78-I80 HydrophobicContact CG1-CG1 4.01Å; V78-I80 PolarHBondContact O-N 2.69Å; V78-W87 HydrophobicContact CB-CB 4.38Å; V78-W87 PolarHBondContact N-O 3.03Å; V78-W87 WeakPolarHBondContact O-CB 3.46Å; V78-W87 PolarHBondContact O-N 2.71Å
79	P	66.7	Low	61.1	Low	95 Å²	95	90.6 Å²	90.6	62%	0.617	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.6	171.5	28.7	-31.3	0	0	0	109	P81	P79-P81 WeakPolarHBondContact O-CD 3.42Å
80	I	65.4	Low	61.1	Low	40 Å²	40	90.4 Å²	90.4	21%	0.205	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	99.3	177.5	-60.9	173.1	0	0	0	107.9	V78 R82 W83 K84 A85 W87	V78-I80 HydrophobicContact CG1-CG1 4.01Å; V78-I80 PolarHBondContact O-N 2.69Å; I80-R82 HydrophobicContact CG2-CB 4.37Å; I80-R82 PolarHBondContact O-N 2.73Å; I80-R82 VanDerWaalsContact O-N 3.16Å; I80-W83 HydrophobicContact CB-CB 4.35Å; I80-W83 HydrophobicContact CB-CD2 4.15Å; I80-W83 HydrophobicContact CB-CE3 4.07Å; I80-W83 HydrophobicContact CB-CG 4.31Å; I80-W83 HydrophobicContact CD1-CD2 4.15Å; I80-W83 HydrophobicContact CD1-CE3 3.44Å; I80-W83 VanDerWaalsContact CD1-CE3 3.44Å; I80-W83 HydrophobicContact CD1-CH2 3.86Å; I80-W83 HydrophobicContact CD1-CZ3 3.29Å; I80-W83 HydrophobicContact CG1-CE3 4.33Å; I80-W83 HydrophobicContact CG2-CB 4.13Å; I80-W83 HydrophobicContact CG2-CD2 3.64Å; I80-W83 HydrophobicContact CG2-CE3 4.02Å; I80-W83 HydrophobicContact CG2-CG 3.69Å; I80-W83 PolarHBondContact O-N 2.62Å; I80-K84 PolarHBondContact O-N 3.48Å; I80-A85 PolarHBondContact N-O 2.83Å; I80-W87 HydrophobicContact CD1-CB 3.9Å; I80-W87 HydrophobicContact CD1-CG 4.28Å
81	P	64.5	Low	61.2	Low	123 Å²	123	85.9 Å²	85.9	80%	0.799	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-57	-36.1	-174.1	-26.2	34	0	0	0	113.2	P79 W83 K84	P79-P81 WeakPolarHBondContact O-CD 3.42Å; P81-W83 PolarHBondContact O-N 2.84Å; P81-K84 PolarHBondContact O-N 2.02Å
82	R	67.1	Low	61.3	Low	227 Å²	227	83 Å²	83	86%	0.857	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-61.3	-27.1	178.3	-171.8	174	174.7	151.1	-0.9	113	I80	I80-R82 HydrophobicContact CG2-CB 4.37Å; I80-R82 PolarHBondContact O-N 2.73Å; I80-R82 VanDerWaalsContact O-N 3.16Å
83	W	57.3	Low	61.5	Low	96 Å²	96	81.7 Å²	81.7	36%	0.364	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-99	-2.9	-176.8	-61.4	-10.3	0	0	0	113	I80 P81 A85 W87	I80-W83 HydrophobicContact CB-CB 4.35Å; I80-W83 HydrophobicContact CB-CD2 4.15Å; I80-W83 HydrophobicContact CB-CE3 4.07Å; I80-W83 HydrophobicContact CB-CG 4.31Å; I80-W83 HydrophobicContact CD1-CD2 4.15Å; I80-W83 HydrophobicContact CD1-CE3 3.44Å; I80-W83 VanDerWaalsContact CD1-CE3 3.44Å; I80-W83 HydrophobicContact CD1-CH2 3.86Å; I80-W83 HydrophobicContact CD1-CZ3 3.29Å; I80-W83 HydrophobicContact CG1-CE3 4.33Å; I80-W83 HydrophobicContact CG2-CB 4.13Å; I80-W83 HydrophobicContact CG2-CD2 3.64Å; I80-W83 HydrophobicContact CG2-CE3 4.02Å; I80-W83 HydrophobicContact CG2-CG 3.69Å; I80-W83 PolarHBondContact O-N 2.62Å; P81-W83 PolarHBondContact O-N 2.84Å; W83-A85 PolarHBondContact O-N 3.22Å; W83-W87 HydrophobicContact CZ3-CG 4.35Å
84	K	58.1	Low	61.7	Low	173 Å²	173	75.9 Å²	75.9	75%	0.752	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	23.8	-172.9	-62.4	-177.2	178.6	178.5	0	113.4	I80 P81	I80-K84 PolarHBondContact O-N 3.48Å; P81-K84 PolarHBondContact O-N 2.02Å
85	A	58.2	Low	62	Low	33 Å²	33	74.1 Å²	74.1	27%	0.273	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	155	-174.8	0	0	0	0	0	110.5	I80 W83	I80-A85 PolarHBondContact N-O 2.83Å; W83-A85 PolarHBondContact O-N 3.22Å
86	V	61.5	Low	62.3	Low	85 Å²	85	70.6 Å²	70.6	52%	0.515	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.1	171.8	-179.1	0	0	0	0	107.9	N77 D88	N77-V86 HydrophobicContact CB-CG1 3.94Å; V86-D88 PolarHBondContact O-N 2.78Å
87	W	62.6	Low	62.2	Low	87 Å²	87	69 Å²	69	33%	0.33	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	106	172.3	-156.7	51.3	0	0	0	108.1	N77 V78 I80 W83 I89 P189	N77-W87 CarbonylContact C-O 3.31Å; N77-W87 VanDerWaalsContact CA-O 3.31Å; N77-W87 WeakPolarHBondContact CA-O 3.45Å; V78-W87 HydrophobicContact CB-CB 4.38Å; V78-W87 PolarHBondContact N-O 3.03Å; V78-W87 WeakPolarHBondContact O-CB 3.46Å; V78-W87 PolarHBondContact O-N 2.71Å; I80-W87 HydrophobicContact CD1-CB 3.9Å; I80-W87 HydrophobicContact CD1-CG 4.28Å; W83-W87 HydrophobicContact CZ3-CG 4.35Å; W87-I89 HydrophobicContact CD2-CD1 4.05Å; W87-I89 HydrophobicContact CD2-CG1 4.23Å; W87-I89 HydrophobicContact CE3-CD1 3.59Å; W87-I89 HydrophobicContact CE3-CG1 4.22Å; W87-I89 HydrophobicContact CH2-CD1 3.43Å; W87-I89 VanDerWaalsContact CH2-CD1 3.43Å; W87-I89 HydrophobicContact CH2-CG1 4.38Å; W87-I89 HydrophobicContact CZ2-CD1 3.85Å; W87-I89 HydrophobicContact CZ2-CG1 4.35Å; W87-I89 HydrophobicContact CZ3-CD1 3.27Å; W87-I89 HydrophobicContact CZ3-CG1 4.31Å; W87-P189 HydrophobicContact CG-CG 4.27Å; W87-P189 PolarHBondContact NE1-O 2.74Å; W87-P189 VanDerWaalsContact NE1-O 3.09Å
88	D	60.7	Low	62	Low	17 Å²	17	65.8 Å²	65.8	9%	0.091	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	91.7	-173	177.1	49.8	0	0	0	109.3	N75 N77 V86 K90 P189 R200	N75-D88 PolarHBondContact OD1-OD1 3.12Å; N77-D88 PolarHBondContact ND2-OD1 2.79Å; N77-D88 PolarHBondContact OD1-OD1 2.81Å; V86-D88 PolarHBondContact O-N 2.78Å; D88-K90 VanDerWaalsContact OD1-CE 3.25Å; D88-K90 WeakPolarHBondContact OD1-CE 3.06Å; D88-K90 IonicContact OD1-NZ 3.9Å; D88-K90 WeakPolarHBondContact OD2-CE 3.5Å; D88-K90 IonicContact OD2-NZ 2.68Å; D88-K90 PolarHBondContact OD2-NZ 3.17Å; D88-P189 WeakPolarHBondContact O-CD 3.3Å; D88-P189 WeakPolarHBondContact O-CG 3.34Å; D88-R200 IonicContact OD2-CZ 2.88Å; D88-R200 IonicContact OD2-NH1 3.08Å; D88-R200 PolarHBondContact OD2-NH1 2.98Å; D88-R200 IonicContact OD2-NH2 2.73Å; D88-R200 PolarHBondContact OD2-NH2 2.92Å
89	I	64.4	Low	61.6	Low	22 Å²	22	63.3 Å²	63.3	11%	0.113	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	123.7	175.8	-62.6	166	0	0	0	108.9	N75 L76 W87 L186 D187 F188	N75-I89 WeakPolarHBondContact CA-O 3.11Å; N75-I89 PolarHBondContact OD1-O 2.9Å; L76-I89 HydrophobicContact CB-CB 4.38Å; L76-I89 HydrophobicContact CD2-CD1 4.4Å; L76-I89 PolarHBondContact N-O 3.1Å; L76-I89 PolarHBondContact O-N 3.41Å; W87-I89 HydrophobicContact CD2-CD1 4.05Å; W87-I89 HydrophobicContact CD2-CG1 4.23Å; W87-I89 HydrophobicContact CE3-CD1 3.59Å; W87-I89 HydrophobicContact CE3-CG1 4.22Å; W87-I89 HydrophobicContact CH2-CD1 3.43Å; W87-I89 VanDerWaalsContact CH2-CD1 3.43Å; W87-I89 HydrophobicContact CH2-CG1 4.38Å; W87-I89 HydrophobicContact CZ2-CD1 3.85Å; W87-I89 HydrophobicContact CZ2-CG1 4.35Å; W87-I89 HydrophobicContact CZ3-CD1 3.27Å; W87-I89 HydrophobicContact CZ3-CG1 4.31Å; I89-L186 HydrophobicContact CG2-CD1 3.77Å; I89-D187 WeakPolarHBondContact CA-O 3.33Å; I89-F188 HydrophobicContact CD1-CD1 4.4Å; I89-F188 HydrophobicContact CG1-CD1 4.22Å; I89-F188 HydrophobicContact CG2-CD1 3.95Å; I89-F188 HydrophobicContact CG2-CE1 4.45Å
90	K	60.6	Low	61.3	Low	56 Å²	56	61.1 Å²	61.1	24%	0.243	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.5	175.9	-72.9	170.2	-176	155.2	0	109.6	N75 D88 L186 D187	N75-K90 WeakPolarHBondContact OD1-CG 3.39Å; D88-K90 VanDerWaalsContact OD1-CE 3.25Å; D88-K90 WeakPolarHBondContact OD1-CE 3.06Å; D88-K90 IonicContact OD1-NZ 3.9Å; D88-K90 WeakPolarHBondContact OD2-CE 3.5Å; D88-K90 IonicContact OD2-NZ 2.68Å; D88-K90 PolarHBondContact OD2-NZ 3.17Å; K90-L186 CarbonylContact O-C 3.55Å; K90-L186 WeakPolarHBondContact O-CA 3.3Å; K90-D187 HydrophobicContact CB-CB 4.4Å; K90-D187 PolarHBondContact N-O 2.76Å; K90-D187 PolarHBondContact O-N 2.89Å
91	G	60.8	Low	61.2	Low	15 Å²	15	60.1 Å²	60.1	16%	0.155	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	140.6	174.2	0	0	0	0	0	110.6	A74 L185	A74-G91 PolarHBondContact N-O 3.36Å; A74-G91 PolarHBondContact O-N 3.14Å; G91-L185 CarbonylContact C-O 3.51Å; G91-L185 WeakPolarHBondContact CA-O 3.4Å
92	Y	58.5	Low	61.1	Low	37 Å²	37	59.1 Å²	59.1	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.8	155.1	72.7	-106.1	0	0	0	109.6	Y22 F71 M72 T94 D183 G184 L185	Y22-Y92 HydrophobicContact CD1-CE1 4.31Å; F71-Y92 HydrophobicContact CE2-CD2 4.37Å; F71-Y92 HydrophobicContact CE2-CG 4.33Å; M72-Y92 CarbonylContact O-C 3.4Å; M72-Y92 VanDerWaalsContact O-CA 3.26Å; M72-Y92 WeakPolarHBondContact O-CA 3.11Å; Y92-T94 HydrophobicContact CD2-CG2 3.57Å; Y92-T94 HydrophobicContact CE2-CG2 3.86Å; Y92-D183 HydrophobicContact CE2-CB 4.44Å; Y92-D183 WeakPolarHBondContact CE2-OD2 3.25Å; Y92-D183 PolarHBondContact OH-OD2 2.96Å; Y92-G184 VanDerWaalsContact O-CA 3.32Å; Y92-G184 WeakPolarHBondContact O-CA 3.17Å; Y92-L185 HydrophobicContact CD1-CB 3.64Å; Y92-L185 HydrophobicContact CD1-CD2 3.99Å; Y92-L185 HydrophobicContact CD1-CG 4.37Å; Y92-L185 HydrophobicContact CD2-CB 4.47Å; Y92-L185 HydrophobicContact CE1-CB 3.21Å; Y92-L185 HydrophobicContact CE1-CD2 3.45Å; Y92-L185 VanDerWaalsContact CE1-CD2 3.45Å; Y92-L185 HydrophobicContact CE1-CG 3.95Å; Y92-L185 HydrophobicContact CE2-CB 4.1Å; Y92-L185 HydrophobicContact CG-CB 4.25Å; Y92-L185 VanDerWaalsContact CZ-CB 3.44Å; Y92-L185 PolarHBondContact N-O 2.95Å; Y92-L185 PolarHBondContact O-N 2.81Å
93	L	60.9	Low	60.9	Low	85 Å²	85	48.4 Å²	48.4	45%	0.445	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	122.2	169.1	-177.1	68.5	0	0	0	107.1	M72 I182 D183	M72-L93 PolarHBondContact N-O 3.42Å; M72-L93 PolarHBondContact O-N 3.23Å; L93-I182 HydrophobicContact CD1-CG2 3.7Å; L93-D183 CarbonylContact C-O 3.52Å; L93-D183 WeakPolarHBondContact CA-O 3.36Å
94	T	57.5	Low	61.4	Low	20 Å²	20	47.6 Å²	47.6	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.3	173.3	86.4	0	0	0	0	107.5	P25 L70 F71 Y92 I182 D183	P25-T94 HydrophobicContact CG-CG2 4.17Å; L70-T94 WeakPolarHBondContact O-CA 2.93Å; F71-T94 HydrophobicContact CD2-CG2 3.46Å; F71-T94 VanDerWaalsContact CD2-CG2 3.46Å; F71-T94 HydrophobicContact CE2-CG2 3.73Å; Y92-T94 HydrophobicContact CD2-CG2 3.57Å; Y92-T94 HydrophobicContact CE2-CG2 3.86Å; T94-I182 CarbonylContact O-C 3.49Å; T94-I182 VanDerWaalsContact O-CA 3.3Å; T94-I182 WeakPolarHBondContact O-CA 3.4Å; T94-D183 PolarHBondContact N-O 2.79Å; T94-D183 PolarHBondContact O-N 3Å
95	S	62.4	Low	61.8	Low	26 Å²	26	39.4 Å²	39.4	18%	0.182	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	115.4	179.2	133.5	0	0	0	0	107.6	G69 L70 Y180 I181	G69-S95 CarbonylContact C-O 3.33Å; G69-S95 WeakPolarHBondContact CA-O 3.48Å; L70-S95 PolarHBondContact N-O 2.85Å; L70-S95 PolarHBondContact O-N 3.25Å; S95-Y180 WeakPolarHBondContact CB-OH 3.49Å; S95-Y180 WeakPolarHBondContact OG-CE2 3.46Å; S95-Y180 VanDerWaalsContact OG-CZ 3.31Å; S95-Y180 PolarHBondContact OG-OH 3.09Å; S95-I181 VanDerWaalsContact CA-O 3.31Å; S95-I181 WeakPolarHBondContact CA-O 3.43Å
96	G	62.4	Low	62.4	Low	14 Å²	14	39.8 Å²	39.8	14%	0.144	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	168.4	-176	0	0	0	0	0	115	G68 Y180 I181	G68-G96 CarbonylContact O-C 3.43Å; G68-G96 WeakPolarHBondContact O-CA 3.25Å; G96-Y180 WeakPolarHBondContact O-CA 3.46Å; G96-Y180 WeakPolarHBondContact O-CD2 2.91Å; G96-I181 PolarHBondContact N-O 2.91Å; G96-I181 PolarHBondContact O-N 3.38Å
97	T	63.6	Low	62.9	Low	64 Å²	64	35.8 Å²	35.8	39%	0.393	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	147.4	173.1	59.2	0	0	0	0	111.2	L27 G67 G68 N179	L27-T97 VanDerWaalsContact CD2-O 3.23Å; L27-T97 WeakPolarHBondContact CD2-O 3.47Å; G67-T97 WeakPolarHBondContact CA-O 3.5Å; G68-T97 PolarHBondContact N-OG1 3.21Å; G68-T97 PolarHBondContact O-N 3.09Å; G68-T97 PolarHBondContact O-OG1 3.45Å; T97-N179 WeakPolarHBondContact CA-O 3.46Å
98	N	61.3	Low	63.3	Low	13 Å²	13	34.3 Å²	34.3	7%	0.07	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-81	144.1	179	-65.3	-18	0	0	0	112.6	L27 S177 N179 I181	L27-N98 HydrophobicContact CD2-CB 4.24Å; L27-N98 VanDerWaalsContact CD2-OD1 3.3Å; L27-N98 WeakPolarHBondContact CD2-OD1 3.47Å; N98-S177 VanDerWaalsContact O-CA 3.25Å; N98-S177 WeakPolarHBondContact O-CA 2.83Å; N98-S177 WeakPolarHBondContact O-CB 3.41Å; N98-N179 PolarHBondContact N-O 2.64Å; N98-I181 VanDerWaalsContact ND2-CD1 3.34Å; N98-I181 WeakPolarHBondContact ND2-CD1 3.14Å; N98-I181 WeakPolarHBondContact OD1-CD1 2.88Å; N98-I181 WeakPolarHBondContact OD1-CG1 3.11Å
99	A	59.3	Low	63.8	Low	1 Å²	1	34 Å²	34	1%	0.008	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-70	142.3	163.8	0	0	0	0	0	109.3	E63 W101	E63-A99 HydrophobicContact CG-CB 3.95Å; E63-A99 WeakPolarHBondContact OE1-CB 3Å; A99-W101 PolarHBondContact O-N 2.99Å
100	P	61.2	Low	63.9	Low	49 Å²	49	36.3 Å²	36.3	32%	0.318	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-66.5	131	173.1	28.4	-31.5	0	0	0	109.7	R64 Q175	R64-P100 PolarHBondContact N-O 3.04Å; R64-P100 WeakPolarHBondContact O-CD 3.25Å; R64-P100 WeakPolarHBondContact O-CG 3.47Å; P100-Q175 VanDerWaalsContact CA-O 3.25Å; P100-Q175 WeakPolarHBondContact CA-O 3.14Å
101	W	61.3	Low	64.4	Low	20 Å²	20	35.3 Å²	35.3	8%	0.076	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	151.7	178.6	62.5	-97.2	0	0	0	111.1	F30 P32 I62 E63 A99 Q173 Q175	F30-W101 HydrophobicContact CB-CZ2 4.03Å; F30-W101 AromaticContact CD1-CH2 3.89Å; F30-W101 HydrophobicContact CD1-CH2 3.89Å; F30-W101 AromaticContact CD1-CZ2 3.92Å; F30-W101 HydrophobicContact CD1-CZ2 3.92Å; F30-W101 HydrophobicContact CG-CZ2 4.18Å; P32-W101 HydrophobicContact CB-CD2 4.22Å; P32-W101 HydrophobicContact CB-CE3 3.63Å; P32-W101 HydrophobicContact CB-CZ3 4.06Å; P32-W101 HydrophobicContact CG-CB 4.25Å; P32-W101 HydrophobicContact CG-CD2 4.34Å; P32-W101 HydrophobicContact CG-CE3 4.2Å; P32-W101 HydrophobicContact CG-CG 4.39Å; I62-W101 CarbonylContact O-C 3.52Å; I62-W101 VanDerWaalsContact O-CA 3.3Å; I62-W101 WeakPolarHBondContact O-CA 3.16Å; E63-W101 HydrophobicContact CB-CB 4.22Å; E63-W101 HydrophobicContact CG-CB 4.26Å; A99-W101 PolarHBondContact O-N 2.99Å; W101-Q173 HydrophobicContact CH2-CB 3.88Å; W101-Q173 HydrophobicContact CH2-CG 4.37Å; W101-Q173 HydrophobicContact CZ3-CB 3.68Å; W101-Q175 HydrophobicContact CD2-CB 3.95Å; W101-Q175 VanDerWaalsContact CE2-CB 3.49Å; W101-Q175 HydrophobicContact CG-CB 4.24Å; W101-Q175 HydrophobicContact CZ2-CB 3.83Å; W101-Q175 PolarHBondContact N-O 2.78Å; W101-Q175 VanDerWaalsContact N-O 3.07Å; W101-Q175 PolarHBondContact O-N 3.22Å
102	Y	63.6	Low	64.8	Low	101 Å²	101	38 Å²	38	40%	0.396	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	137.7	174	174.8	-98.4	0	0	0	108.5	G61 I62 Q173 A174	G61-Y102 CarbonylContact C-O 3.6Å; G61-Y102 WeakPolarHBondContact CA-O 3.28Å; I62-Y102 HydrophobicContact CG2-CD1 4.23Å; I62-Y102 PolarHBondContact N-O 2.92Å; I62-Y102 PolarHBondContact O-N 3.49Å; Y102-Q173 CarbonylContact C-O 3.59Å; Y102-Q173 WeakPolarHBondContact CA-O 2.97Å; Y102-Q173 WeakPolarHBondContact CD2-O 3.05Å; Y102-A174 HydrophobicContact CD2-CB 3.96Å
103	S	62.8	Low	65.1	Low	3 Å²	3	40.8 Å²	40.8	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	138.4	177.7	-170.8	0	0	0	0	110.1	P32 N60 P148 V172 Q173	P32-S103 PolarHBondContact O-OG 3.02Å; P32-S103 VanDerWaalsContact O-OG 3.08Å; N60-S103 WeakPolarHBondContact O-CA 3.23Å; N60-S103 PolarHBondContact O-OG 2.91Å; S103-P148 VanDerWaalsContact OG-CG 3.25Å; S103-P148 WeakPolarHBondContact OG-CG 3.5Å; S103-V172 WeakPolarHBondContact O-CA 3.3Å; S103-Q173 PolarHBondContact N-O 3.21Å; S103-Q173 PolarHBondContact O-N 3.44Å
104	Y	67.4	Low	65.6	Low	78 Å²	78	41.8 Å²	41.8	31%	0.306	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	126.7	179	169.9	-95.6	0	0	0	109.2	F58 A59 N60 H106 L170 V172	F58-Y104 HydrophobicContact CD1-CD1 4.34Å; F58-Y104 HydrophobicContact CD1-CE1 4.07Å; F58-Y104 HydrophobicContact CE1-CD1 4.35Å; F58-Y104 HydrophobicContact CE1-CE1 4.24Å; A59-Y104 WeakPolarHBondContact CA-O 3.22Å; N60-Y104 PolarHBondContact N-O 2.95Å; N60-Y104 PolarHBondContact O-N 3.25Å; Y104-H106 AromaticContact CE1-ND1 3.31Å; Y104-H106 VanDerWaalsContact CE1-ND1 3.31Å; Y104-H106 WeakPolarHBondContact CE1-ND1 3.04Å; Y104-H106 AromaticContact CZ-ND1 3.58Å; Y104-H106 PolarHBondContact OH-ND1 3.47Å; Y104-L170 HydrophobicContact CD2-CD1 4.43Å; Y104-L170 HydrophobicContact CE2-CD1 3.55Å; Y104-V172 HydrophobicContact CD2-CG1 3.61Å; Y104-V172 HydrophobicContact CE2-CG1 4.21Å
105	G	67.3	Low	66.3	Low	1 Å²	1	51.5 Å²	51.5	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	147.4	172	0	0	0	0	0	112.3	F58 L147 G171	F58-G105 CarbonylContact O-C 3.34Å; F58-G105 WeakPolarHBondContact O-CA 3.44Å; G105-L147 WeakPolarHBondContact O-CD2 3.21Å; G105-G171 PolarHBondContact N-O 2.65Å; G105-G171 PolarHBondContact O-N 3.45Å
106	H	70.6	Confident	66.8	Low	42 Å²	42	52.2 Å²	52.2	19%	0.194	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	149.3	169.3	67	-88.1	0	0	0	111.9	H56 F58 Y104 G169 L170	H56-H106 AromaticContact CE1-NE2 3.83Å; H56-H106 AromaticContact ND1-NE2 3.8Å; F58-H106 WeakPolarHBondContact CB-CE1 3.19Å; F58-H106 AromaticContact CD1-CE1 3.36Å; F58-H106 WeakPolarHBondContact CD1-CE1 3.34Å; F58-H106 AromaticContact CD1-ND1 3.68Å; F58-H106 AromaticContact CG-CE1 3.69Å; F58-H106 PolarHBondContact N-O 2.57Å; F58-H106 PolarHBondContact O-N 2.72Å; Y104-H106 AromaticContact CE1-ND1 3.31Å; Y104-H106 VanDerWaalsContact CE1-ND1 3.31Å; Y104-H106 WeakPolarHBondContact CE1-ND1 3.04Å; Y104-H106 AromaticContact CZ-ND1 3.58Å; Y104-H106 PolarHBondContact OH-ND1 3.47Å; H106-G169 CarbonylContact C-O 3.59Å; H106-G169 VanDerWaalsContact CA-O 3.25Å; H106-G169 WeakPolarHBondContact CA-O 3.46Å; H106-L170 HydrophobicContact CB-CD1 4.14Å
107	L	72.3	Confident	67.7	Low	1 Å²	1	57.8 Å²	57.8	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126	172.2	173	66.1	0	0	0	108.1	H56 Q57 V144 A145 L147 P153 V154 I168 G169	H56-L107 WeakPolarHBondContact O-CA 3.33Å; H56-L107 WeakPolarHBondContact O-CD1 3.22Å; Q57-L107 HydrophobicContact CB-CD1 4.19Å; L107-V144 HydrophobicContact CD1-CG1 4.27Å; L107-A145 HydrophobicContact CB-CB 4.19Å; L107-A145 HydrophobicContact CD1-CB 3.91Å; L107-A145 HydrophobicContact CD2-CB 3.96Å; L107-A145 HydrophobicContact CG-CB 4.23Å; L107-L147 HydrophobicContact CB-CD1 4.16Å; L107-P153 HydrophobicContact CD2-CG 3.58Å; L107-V154 HydrophobicContact CD2-CG2 4.17Å; L107-I168 WeakPolarHBondContact O-CA 3.19Å; L107-G169 PolarHBondContact N-O 2.94Å; L107-G169 PolarHBondContact O-N 3.28Å
108	V	70.8	Confident	68.2	Low	56 Å²	56	59.9 Å²	59.9	34%	0.339	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.9	176.1	179	0	0	0	0	110	H56 V111	H56-V108 PolarHBondContact N-O 2.89Å; H56-V108 PolarHBondContact O-N 2.88Å; V108-V111 HydrophobicContact CG1-CG1 4.29Å
109	R	69.9	Low	69	Low	10 Å²	10	63.1 Å²	63.1	4%	0.038	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	145.3	179.7	-178.9	-167.3	-175.5	74.1	18.2	110.2	C161 N162 P163 S166 T167	R109-C161 PolarHBondContact NH2-O 3.38Å; R109-N162 VanDerWaalsContact CZ-O 3.26Å; R109-N162 PolarHBondContact NE-O 2.94Å; R109-N162 PolarHBondContact NH2-O 2.91Å; R109-P163 VanDerWaalsContact NH2-N 3.17Å; R109-S166 CarbonylContact O-C 3.29Å; R109-S166 VanDerWaalsContact O-CA 3.25Å; R109-S166 WeakPolarHBondContact O-CA 3.14Å; R109-T167 PolarHBondContact N-O 3.23Å; R109-T167 PolarHBondContact O-N 2.93Å
110	P	68.1	Low	70	Confident	70 Å²	70	66.4 Å²	66.4	46%	0.455	33%	0.333	S	S	.	.	S	Bend	cis	-79.7	141.7	-8	32	-34.2	0	0	0	111.5	L54 P163	L54-P110 WeakPolarHBondContact O-CA 3.42Å; P110-P163 WeakPolarHBondContact CB-O 3.49Å; P110-P163 WeakPolarHBondContact CG-O 3.29Å
111	V	69.8	Low	70.6	Confident	36 Å²	36	65.2 Å²	65.2	22%	0.218	32%	0.324	C	S	.	.			trans	-115.4	161	161.3	-63	0	0	0	0	107.9	L54 H56 V108 M113	L54-V111 CarbonylContact C-O 3.49Å; L54-V111 WeakPolarHBondContact CA-O 3.32Å; L54-V111 PolarHBondContact O-N 3.42Å; H56-V111 HydrophobicContact CB-CB 4.34Å; H56-V111 HydrophobicContact CB-CG1 3.8Å; H56-V111 HydrophobicContact CB-CG2 3.79Å; V108-V111 HydrophobicContact CG1-CG1 4.29Å; V111-M113 HydrophobicContact CG2-CE 3.96Å; V111-M113 HydrophobicContact CG2-CG 4.05Å
112	N	70.5	Confident	71.1	Confident	70 Å²	70	68.4 Å²	68.4	37%	0.374	34%	0.341	S	S	.	.			trans	-123	75.2	177.8	-174.8	12.9	0	0	0	109.8	L114 R115 L116	N112-L114 VanDerWaalsContact C-N 3.26Å; N112-L114 PolarHBondContact O-N 2.87Å; N112-R115 PolarHBondContact O-N 3.14Å; N112-R115 WeakPolarHBondContact OD1-CA 3.43Å; N112-R115 PolarHBondContact OD1-N 2.92Å; N112-R115 VanDerWaalsContact OD1-N 3.1Å; N112-L116 PolarHBondContact ND2-N 3.28Å; N112-L116 VanDerWaalsContact ND2-N 3.17Å; N112-L116 PolarHBondContact ND2-O 3.15Å; N112-L116 PolarHBondContact OD1-N 3.26Å
113	M	64.9	Low	71.9	Confident	97 Å²	97	72.7 Å²	72.7	48%	0.478	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-34.7	-178.3	-63	-168.7	-175.9	0	0	111.9	P53 S55 H56 V111 R115	P53-M113 PolarHBondContact O-N 2.98Å; S55-M113 WeakPolarHBondContact O-CE 3.33Å; H56-M113 VanDerWaalsContact CA-CE 3.44Å; H56-M113 HydrophobicContact CB-CE 3.54Å; H56-M113 VanDerWaalsContact CD2-CE 3.43Å; H56-M113 WeakPolarHBondContact CD2-CE 3.39Å; V111-M113 HydrophobicContact CG2-CE 3.96Å; V111-M113 HydrophobicContact CG2-CG 4.05Å; M113-R115 PolarHBondContact O-N 3.21Å
114	L	70	Confident	72.3	Confident	105 Å²	105	75 Å²	75	55%	0.55	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-0.2	179.4	-64	-173.4	0	0	0	113.8	P53 N112 L116	P53-L114 HydrophobicContact CB-CD1 3.29Å; P53-L114 HydrophobicContact CB-CG 3.6Å; P53-L114 HydrophobicContact CG-CD1 4.04Å; N112-L114 VanDerWaalsContact C-N 3.26Å; N112-L114 PolarHBondContact O-N 2.87Å; L114-L116 HydrophobicContact CB-CD1 4.13Å; L114-L116 HydrophobicContact CB-CD2 4.33Å; L114-L116 HydrophobicContact CB-CG 3.77Å; L114-L116 HydrophobicContact CD1-CD1 4.19Å; L114-L116 PolarHBondContact O-N 3.12Å; L114-L116 VanDerWaalsContact O-N 3.14Å
115	R	71.8	Confident	72.5	Confident	225 Å²	225	73.4 Å²	73.4	85%	0.849	36%	0.363	S	S	*	.			trans	51.4	33.8	-177.3	-59	-176.9	178.1	-178.2	-0.7	113.7	N112 M113	N112-R115 PolarHBondContact O-N 3.14Å; N112-R115 WeakPolarHBondContact OD1-CA 3.43Å; N112-R115 PolarHBondContact OD1-N 2.92Å; N112-R115 VanDerWaalsContact OD1-N 3.1Å; M113-R115 PolarHBondContact O-N 3.21Å
116	L	73.7	Confident	72.9	Confident	40 Å²	40	79.4 Å²	79.4	21%	0.209	39%	0.394	C	S	.	.			trans	-68	141.1	178.7	-63.1	173.3	0	0	0	110.9	N112 L114 E120 I121	N112-L116 PolarHBondContact ND2-N 3.28Å; N112-L116 VanDerWaalsContact ND2-N 3.17Å; N112-L116 PolarHBondContact ND2-O 3.15Å; N112-L116 PolarHBondContact OD1-N 3.26Å; L114-L116 HydrophobicContact CB-CD1 4.13Å; L114-L116 HydrophobicContact CB-CD2 4.33Å; L114-L116 HydrophobicContact CB-CG 3.77Å; L114-L116 HydrophobicContact CD1-CD1 4.19Å; L114-L116 PolarHBondContact O-N 3.12Å; L114-L116 VanDerWaalsContact O-N 3.14Å; L116-E120 WeakPolarHBondContact CA-OE2 3.46Å; L116-I121 HydrophobicContact CB-CD1 4.28Å; L116-I121 HydrophobicContact CB-CG1 3.82Å; L116-I121 HydrophobicContact CD1-CG1 4.27Å
117	K	81.9	Confident	73.3	Confident	132 Å²	132	80.3 Å²	80.3	57%	0.574	40%	0.401	S	S	*	.			trans	-69.1	149.7	172.2	-65.7	177	-177.9	172.7	0	109.8	S119 E120 I121	K117-S119 PolarHBondContact O-N 3.13Å; K117-S119 VanDerWaalsContact O-N 3.13Å; K117-E120 HydrophobicContact CB-CB 4.48Å; K117-E120 HydrophobicContact CB-CG 4.11Å; K117-E120 PolarHBondContact N-OE2 3.33Å; K117-E120 WeakPolarHBondContact O-CA 3.4Å; K117-E120 WeakPolarHBondContact O-CB 3.41Å; K117-E120 PolarHBondContact O-N 3.3Å; K117-I121 PolarHBondContact O-N 2.88Å; K117-I121 VanDerWaalsContact O-N 3.07Å
118	P	73.8	Confident	73.6	Confident	107 Å²	107	84.7 Å²	84.7	70%	0.695	43%	0.43	S	S	*	.	H	α-helix	trans	-54	-34.7	175.1	-26.9	34.8	0	0	0	113.2	I121 M122	P118-I121 PolarHBondContact O-N 3.05Å; P118-M122 WeakPolarHBondContact O-CG 3.5Å; P118-M122 PolarHBondContact O-N 2.94Å
119	S	79.1	Confident	73.9	Confident	81 Å²	81	84.8 Å²	84.8	57%	0.566	44%	0.436	S	S	*	.	H	α-helix	trans	-66.2	-34.2	174.7	53.1	0	0	0	0	113.4	K117 R123	K117-S119 PolarHBondContact O-N 3.13Å; K117-S119 VanDerWaalsContact O-N 3.13Å; S119-R123 WeakPolarHBondContact O-CB 3.47Å; S119-R123 PolarHBondContact O-N 3.24Å
120	E	79.2	Confident	74	Confident	70 Å²	70	86.7 Å²	86.7	33%	0.327	45%	0.445	S	S	.	.	H	α-helix	trans	-72.5	-40.7	176.6	-68.1	164.3	177.7	0	0	111	L116 K117 M122 R123 M124	L116-E120 WeakPolarHBondContact CA-OE2 3.46Å; K117-E120 HydrophobicContact CB-CB 4.48Å; K117-E120 HydrophobicContact CB-CG 4.11Å; K117-E120 PolarHBondContact N-OE2 3.33Å; K117-E120 WeakPolarHBondContact O-CA 3.4Å; K117-E120 WeakPolarHBondContact O-CB 3.41Å; K117-E120 PolarHBondContact O-N 3.3Å; E120-M122 VanDerWaalsContact C-N 3.35Å; E120-R123 PolarHBondContact O-N 3.06Å; E120-M124 VanDerWaalsContact O-CB 3.26Å; E120-M124 WeakPolarHBondContact O-CB 3.43Å; E120-M124 PolarHBondContact O-N 2.82Å
121	I	73.5	Confident	74.1	Confident	25 Å²	25	87.3 Å²	87.3	13%	0.128	44%	0.441	C	S	.	.	H	α-helix	trans	-60.6	-46.4	174.4	-62.5	173.6	0	0	0	110.1	L54 L116 K117 P118 M124 M125 P163	L54-I121 HydrophobicContact CD1-CG2 4.28Å; L54-I121 HydrophobicContact CD2-CD1 4.27Å; L116-I121 HydrophobicContact CB-CD1 4.28Å; L116-I121 HydrophobicContact CB-CG1 3.82Å; L116-I121 HydrophobicContact CD1-CG1 4.27Å; K117-I121 PolarHBondContact O-N 2.88Å; K117-I121 VanDerWaalsContact O-N 3.07Å; P118-I121 PolarHBondContact O-N 3.05Å; I121-M124 PolarHBondContact O-N 3.13Å; I121-M125 HydrophobicContact CG2-SD 4.43Å; I121-M125 WeakPolarHBondContact O-CG 3.3Å; I121-M125 PolarHBondContact O-N 2.81Å; I121-P163 HydrophobicContact CG2-CB 4.33Å; I121-P163 HydrophobicContact CG2-CG 3.68Å
122	M	72.6	Confident	74.1	Confident	87 Å²	87	91.6 Å²	91.6	43%	0.429	46%	0.459	S	S	.	.	H	α-helix	trans	-61.7	-46.3	176.1	-74.5	-65.9	-168.9	0	0	111.8	P118 E120 M124 M125 L126 F164	P118-M122 WeakPolarHBondContact O-CG 3.5Å; P118-M122 PolarHBondContact O-N 2.94Å; E120-M122 VanDerWaalsContact C-N 3.35Å; M122-M124 VanDerWaalsContact C-N 3.31Å; M122-M124 PolarHBondContact O-N 3.17Å; M122-M125 PolarHBondContact O-N 2.89Å; M122-L126 WeakPolarHBondContact O-CB 3.36Å; M122-L126 WeakPolarHBondContact O-CG 3.46Å; M122-L126 PolarHBondContact O-N 3.12Å; M122-F164 HydrophobicContact CE-CE1 3.5Å; M122-F164 HydrophobicContact CE-CE2 3.95Å; M122-F164 HydrophobicContact CE-CZ 3.13Å; M122-F164 HydrophobicContact CG-CZ 4.48Å; M122-F164 HydrophobicContact SD-CE1 4.37Å; M122-F164 HydrophobicContact SD-CE2 4.02Å; M122-F164 HydrophobicContact SD-CZ 3.45Å; M122-F164 WeakPolarHBondContact SD-CZ 3.32Å
123	R	79.1	Confident	74	Confident	190 Å²	190	90.2 Å²	90.2	72%	0.717	46%	0.458	S	S	*	.	H	α-helix	trans	-60.5	-41.9	178.3	-169.7	172.9	73.3	164.2	2.7	111.7	S119 E120 L126 D127	S119-R123 WeakPolarHBondContact O-CB 3.47Å; S119-R123 PolarHBondContact O-N 3.24Å; E120-R123 PolarHBondContact O-N 3.06Å; R123-L126 PolarHBondContact O-N 3.43Å; R123-D127 WeakPolarHBondContact O-CB 3.45Å; R123-D127 PolarHBondContact O-N 2.94Å
124	M	72.6	Confident	74	Confident	52 Å²	52	88.8 Å²	88.8	26%	0.256	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-35.7	177.6	-171.2	-179.5	-167	0	0	112.7	E120 I121 M122 F130 I160	E120-M124 VanDerWaalsContact O-CB 3.26Å; E120-M124 WeakPolarHBondContact O-CB 3.43Å; E120-M124 PolarHBondContact O-N 2.82Å; I121-M124 PolarHBondContact O-N 3.13Å; M122-M124 VanDerWaalsContact C-N 3.31Å; M122-M124 PolarHBondContact O-N 3.17Å; M124-F130 HydrophobicContact CE-CD1 4.45Å; M124-F130 HydrophobicContact CE-CE1 3.39Å; M124-F130 HydrophobicContact CE-CE2 3.89Å; M124-F130 HydrophobicContact CE-CZ 3.06Å; M124-F130 HydrophobicContact CG-CD1 4.23Å; M124-F130 HydrophobicContact CG-CD2 3.87Å; M124-F130 HydrophobicContact CG-CE1 3.97Å; M124-F130 HydrophobicContact CG-CE2 3.58Å; M124-F130 HydrophobicContact CG-CG 4.21Å; M124-F130 HydrophobicContact CG-CZ 3.68Å; M124-F130 VanDerWaalsContact O-CB 3.31Å; M124-F130 WeakPolarHBondContact O-CB 3.25Å; M124-F130 WeakPolarHBondContact O-CD2 3.2Å; M124-F130 VanDerWaalsContact O-CG 3.31Å; M124-F130 WeakPolarHBondContact O-CG 3.16Å; M124-F130 HydrophobicContact SD-CE1 4.47Å; M124-F130 HydrophobicContact SD-CZ 4.22Å; M124-I160 HydrophobicContact CE-CD1 3.15Å; M124-I160 HydrophobicContact CE-CG1 4.21Å; M124-I160 HydrophobicContact CG-CD1 4.44Å; M124-I160 HydrophobicContact SD-CD1 3.35Å; M124-I160 WeakPolarHBondContact SD-CD1 3.19Å
125	M	70.2	Confident	73.8	Confident	44 Å²	44	90 Å²	90	22%	0.217	44%	0.444	C	S	.	.	H	α-helix	trans	-73.5	-30.9	175.7	-73.9	-175.1	64.3	0	0	113.4	I121 M122 P163 F164	I121-M125 HydrophobicContact CG2-SD 4.43Å; I121-M125 WeakPolarHBondContact O-CG 3.3Å; I121-M125 PolarHBondContact O-N 2.81Å; M122-M125 PolarHBondContact O-N 2.89Å; M125-P163 WeakPolarHBondContact SD-CD 3.4Å; M125-P163 HydrophobicContact SD-CG 3.56Å; M125-P163 VanDerWaalsContact SD-CG 3.56Å; M125-F164 HydrophobicContact CE-CD2 4.32Å; M125-F164 HydrophobicContact CE-CE2 3.87Å; M125-F164 HydrophobicContact SD-CD2 4.37Å; M125-F164 HydrophobicContact SD-CE2 3.54Å; M125-F164 VanDerWaalsContact SD-CE2 3.54Å; M125-F164 HydrophobicContact SD-CZ 4.17Å
126	L	75.6	Confident	73.6	Confident	127 Å²	127	83.9 Å²	83.9	67%	0.665	43%	0.432	S	S	*	.	H	α-helix	trans	-86.3	-13	178.1	-67.3	170.4	0	0	0	112.8	M122 R123	M122-L126 WeakPolarHBondContact O-CB 3.36Å; M122-L126 WeakPolarHBondContact O-CG 3.46Å; M122-L126 PolarHBondContact O-N 3.12Å; R123-L126 PolarHBondContact O-N 3.43Å
127	D	80	Confident	73	Confident	61 Å²	61	84.5 Å²	84.5	33%	0.326	44%	0.435	S	S	.	.			trans	-62.7	122.7	-179.6	-170.8	-21.7	0	0	0	110.6	R123 A129 F130 Q131	R123-D127 WeakPolarHBondContact O-CB 3.45Å; R123-D127 PolarHBondContact O-N 2.94Å; D127-A129 PolarHBondContact O-N 2.81Å; D127-A129 WeakPolarHBondContact OD1-CB 3.45Å; D127-A129 PolarHBondContact OD1-N 3.34Å; D127-F130 HydrophobicContact CB-CB 4.35Å; D127-F130 HydrophobicContact CB-CD2 4Å; D127-F130 WeakPolarHBondContact O-CB 3.43Å; D127-F130 PolarHBondContact O-N 2.88Å; D127-F130 VanDerWaalsContact O-N 3.08Å; D127-Q131 PolarHBondContact O-N 2.73Å
128	P	78	Confident	71.8	Confident	94 Å²	94	84.1 Å²	84.1	61%	0.61	45%	0.446	S	S	*	.	H	α-helix	trans	-57.5	-32.4	178	23.5	-34.5	0	0	0	112.7	F130 Q131 E132	P128-F130 VanDerWaalsContact C-N 3.31Å; P128-F130 PolarHBondContact O-N 2.68Å; P128-Q131 PolarHBondContact O-N 2.9Å; P128-E132 WeakPolarHBondContact O-CB 3.4Å; P128-E132 PolarHBondContact O-N 2.95Å
129	A	77	Confident	71	Confident	57 Å²	57	81.2 Å²	81.2	47%	0.471	43%	0.428	S	S	.	.	H	α-helix	trans	-63.9	-37.6	177.6	0	0	0	0	0	111.8	D127 A133	D127-A129 PolarHBondContact O-N 2.81Å; D127-A129 WeakPolarHBondContact OD1-CB 3.45Å; D127-A129 PolarHBondContact OD1-N 3.34Å; A129-A133 WeakPolarHBondContact O-CB 3.37Å; A129-A133 PolarHBondContact O-N 2.83Å
130	F	71.9	Confident	70	Confident	51 Å²	51	82.1 Å²	82.1	22%	0.224	43%	0.432	C	S	.	.	H	α-helix	trans	-68.9	-39.8	175	-92.1	-88.3	0	0	0	112.3	M124 D127 P128 R134 P159	M124-F130 HydrophobicContact CE-CD1 4.45Å; M124-F130 HydrophobicContact CE-CE1 3.39Å; M124-F130 HydrophobicContact CE-CE2 3.89Å; M124-F130 HydrophobicContact CE-CZ 3.06Å; M124-F130 HydrophobicContact CG-CD1 4.23Å; M124-F130 HydrophobicContact CG-CD2 3.87Å; M124-F130 HydrophobicContact CG-CE1 3.97Å; M124-F130 HydrophobicContact CG-CE2 3.58Å; M124-F130 HydrophobicContact CG-CG 4.21Å; M124-F130 HydrophobicContact CG-CZ 3.68Å; M124-F130 VanDerWaalsContact O-CB 3.31Å; M124-F130 WeakPolarHBondContact O-CB 3.25Å; M124-F130 WeakPolarHBondContact O-CD2 3.2Å; M124-F130 VanDerWaalsContact O-CG 3.31Å; M124-F130 WeakPolarHBondContact O-CG 3.16Å; M124-F130 HydrophobicContact SD-CE1 4.47Å; M124-F130 HydrophobicContact SD-CZ 4.22Å; D127-F130 HydrophobicContact CB-CB 4.35Å; D127-F130 HydrophobicContact CB-CD2 4Å; D127-F130 WeakPolarHBondContact O-CB 3.43Å; D127-F130 PolarHBondContact O-N 2.88Å; D127-F130 VanDerWaalsContact O-N 3.08Å; P128-F130 VanDerWaalsContact C-N 3.31Å; P128-F130 PolarHBondContact O-N 2.68Å; F130-R134 WeakPolarHBondContact O-CG 3.38Å; F130-R134 PolarHBondContact O-N 3.21Å; F130-P159 HydrophobicContact CD1-CG 3.43Å; F130-P159 VanDerWaalsContact CD1-CG 3.43Å; F130-P159 HydrophobicContact CE1-CB 4.17Å; F130-P159 HydrophobicContact CE1-CG 3.3Å
131	Q	70.7	Confident	69.2	Low	82 Å²	82	81.9 Å²	81.9	38%	0.383	44%	0.437	S	S	.	.	H	α-helix	trans	-68	-39.7	176.8	-64.4	-169.4	11.1	0	0	111.7	D127 P128 R134 R135	D127-Q131 PolarHBondContact O-N 2.73Å; P128-Q131 PolarHBondContact O-N 2.9Å; Q131-R134 PolarHBondContact O-N 2.7Å; Q131-R135 VanDerWaalsContact O-CG 3.28Å; Q131-R135 WeakPolarHBondContact O-CG 3.47Å; Q131-R135 PolarHBondContact O-N 2.79Å
132	E	70.6	Confident	68.6	Low	126 Å²	126	81.6 Å²	81.6	59%	0.589	44%	0.437	S	S	*	.	H	α-helix	trans	-65.9	-46.3	176.4	-169.4	163	-159.1	0	0	110.7	P128 R134 R135 T136	P128-E132 WeakPolarHBondContact O-CB 3.4Å; P128-E132 PolarHBondContact O-N 2.95Å; E132-R134 VanDerWaalsContact C-N 3.25Å; E132-R134 PolarHBondContact O-N 2.74Å; E132-R135 CarbonylContact O-C 3.57Å; E132-R135 WeakPolarHBondContact O-CA 3.31Å; E132-R135 WeakPolarHBondContact O-CB 3.46Å; E132-R135 PolarHBondContact O-N 3.44Å; E132-T136 HydrophobicContact CG-CG2 3.9Å; E132-T136 WeakPolarHBondContact O-CB 3.45Å; E132-T136 WeakPolarHBondContact O-CG2 2.85Å; E132-T136 PolarHBondContact O-N 3.22Å; E132-T136 PolarHBondContact O-OG1 3.03Å
133	A	67.1	Low	68	Low	42 Å²	42	78 Å²	78	35%	0.347	42%	0.42	S	S	.	.	H	α-helix	trans	-57.4	-36.1	173.3	0	0	0	0	0	113	A129 T136 N137	A129-A133 WeakPolarHBondContact O-CB 3.37Å; A129-A133 PolarHBondContact O-N 2.83Å; A133-T136 WeakPolarHBondContact CA-OG1 3.05Å; A133-T136 PolarHBondContact O-OG1 3.45Å; A133-N137 WeakPolarHBondContact O-CB 3.36Å; A133-N137 PolarHBondContact O-N 3.29Å
134	R	65.6	Low	67.2	Low	66 Å²	66	69.1 Å²	69.1	25%	0.249	39%	0.387	C	S	.	.	H	α-helix	trans	-69.8	-32.1	173.3	-79.3	-176.3	179.9	176.4	7.3	113.5	F130 Q131 E132 I160	F130-R134 WeakPolarHBondContact O-CG 3.38Å; F130-R134 PolarHBondContact O-N 3.21Å; Q131-R134 PolarHBondContact O-N 2.7Å; E132-R134 VanDerWaalsContact C-N 3.25Å; E132-R134 PolarHBondContact O-N 2.74Å; R134-I160 PolarHBondContact NH2-O 3.24Å
135	R	66.8	Low	66.6	Low	132 Å²	132	66.9 Å²	66.9	50%	0.498	38%	0.376	S	S	.	.	H	α-helix	trans	-80.4	-43.6	179.4	-74	176.1	-170.2	-60.8	-12.5	112.3	Q131 E132 N137 R230	Q131-R135 VanDerWaalsContact O-CG 3.28Å; Q131-R135 WeakPolarHBondContact O-CG 3.47Å; Q131-R135 PolarHBondContact O-N 2.79Å; E132-R135 CarbonylContact O-C 3.57Å; E132-R135 WeakPolarHBondContact O-CA 3.31Å; E132-R135 WeakPolarHBondContact O-CB 3.46Å; E132-R135 PolarHBondContact O-N 3.44Å; R135-N137 VanDerWaalsContact C-N 3.28Å; R135-R230 VanDerWaalsContact NH1-NE 3.14Å
136	T	66.8	Low	66	Low	96 Å²	96	68.3 Å²	68.3	59%	0.589	38%	0.379	S	S	*	.	H	α-helix	trans	-72.9	-26.7	-176.7	54.4	0	0	0	0	111.2	E132 A133 P138	E132-T136 HydrophobicContact CG-CG2 3.9Å; E132-T136 WeakPolarHBondContact O-CB 3.45Å; E132-T136 WeakPolarHBondContact O-CG2 2.85Å; E132-T136 PolarHBondContact O-N 3.22Å; E132-T136 PolarHBondContact O-OG1 3.03Å; A133-T136 WeakPolarHBondContact CA-OG1 3.05Å; A133-T136 PolarHBondContact O-OG1 3.45Å; T136-P138 WeakPolarHBondContact O-CD 3.33Å
137	N	61.2	Low	65.2	Low	52 Å²	52	62.5 Å²	62.5	28%	0.278	35%	0.349	S	S	.	.			trans	-74	106.8	175.4	-165.5	-12.5	0	0	0	110.4	A133 R135 S139 P158	A133-N137 WeakPolarHBondContact O-CB 3.36Å; A133-N137 PolarHBondContact O-N 3.29Å; R135-N137 VanDerWaalsContact C-N 3.28Å; N137-S139 PolarHBondContact O-N 2.78Å; N137-S139 WeakPolarHBondContact OD1-CB 3.38Å; N137-S139 PolarHBondContact OD1-N 3.43Å; N137-S139 PolarHBondContact OD1-OG 3.37Å; N137-P158 WeakPolarHBondContact ND2-CG 3.09Å
138	P	56.9	Low	64.1	Low	125 Å²	125	60.2 Å²	60.2	81%	0.812	34%	0.338	S	S	*	.			trans	-77.6	1.2	179.8	35.7	-33.3	0	0	0	111.9	T136	T136-P138 WeakPolarHBondContact O-CD 3.33Å
139	S	57.1	Low	63	Low	45 Å²	45	57.8 Å²	57.8	32%	0.315	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-60.1	135.4	-176.4	-60.5	0	0	0	0	110.8	N137	N137-S139 PolarHBondContact O-N 2.78Å; N137-S139 WeakPolarHBondContact OD1-CB 3.38Å; N137-S139 PolarHBondContact OD1-N 3.43Å; N137-S139 PolarHBondContact OD1-OG 3.37Å
140	P	58	Low	62.1	Low	100 Å²	100	59.3 Å²	59.3	65%	0.649	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-57.1	154.8	168.9	26.4	-33.4	0	0	0	109.5	V142	P140-V142 WeakPolarHBondContact O-CG2 3.49Å; P140-V142 PolarHBondContact O-N 3.21Å; P140-V142 VanDerWaalsContact O-N 3.12Å
141	P	61.4	Low	61.4	Low	65 Å²	65	59.6 Å²	59.6	42%	0.422	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-56.9	125.4	178.1	29.2	-36.6	0	0	0	109.3	C156	P141-C156 CarbonylContact C-O 3.35Å
142	V	61.6	Low	61.1	Low	20 Å²	20	57.3 Å²	57.3	12%	0.121	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	136.9	-173.3	174.5	0	0	0	0	107.5	F40 P50 P140 V144 Y155 C156	F40-V142 HydrophobicContact CD1-CB 4.44Å; F40-V142 HydrophobicContact CD1-CG1 3.64Å; F40-V142 HydrophobicContact CD2-CG1 3.78Å; F40-V142 HydrophobicContact CE1-CB 4.09Å; F40-V142 HydrophobicContact CE1-CG1 3.24Å; F40-V142 HydrophobicContact CE2-CG1 3.36Å; F40-V142 HydrophobicContact CG-CG1 3.94Å; F40-V142 HydrophobicContact CZ-CB 4.32Å; F40-V142 HydrophobicContact CZ-CG1 3.12Å; P50-V142 HydrophobicContact CG-CG1 4.06Å; P140-V142 WeakPolarHBondContact O-CG2 3.49Å; P140-V142 PolarHBondContact O-N 3.21Å; P140-V142 VanDerWaalsContact O-N 3.12Å; V142-V144 PolarHBondContact O-N 2.77Å; V142-Y155 WeakPolarHBondContact O-CA 3.34Å; V142-C156 PolarHBondContact N-O 2.85Å; V142-C156 PolarHBondContact O-N 2.84Å
143	S	61	Low	60.7	Low	11 Å²	11	51.6 Å²	51.6	8%	0.077	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	136.8	176.3	55.2	0	0	0	0	110.5	F40 V154	F40-S143 VanDerWaalsContact CE1-N 3.34Å; F40-S143 VanDerWaalsContact CE1-OG 3.28Å; F40-S143 WeakPolarHBondContact CE1-OG 3.5Å; F40-S143 WeakPolarHBondContact CZ-O 3.42Å; F40-S143 VanDerWaalsContact CZ-OG 3.25Å; F40-S143 WeakPolarHBondContact CZ-OG 3.31Å; S143-V154 WeakPolarHBondContact CA-O 3.43Å
144	V	61.3	Low	60.5	Low	4 Å²	4	50 Å²	50	2%	0.024	27%	0.273	C	S	.	.	S	Bend	trans	-78	-38.1	-179	178.2	0	0	0	0	110.9	F52 S55 Q57 L107 V142 V154 C156 C161	F52-V144 HydrophobicContact CB-CG1 4.47Å; F52-V144 HydrophobicContact CD2-CB 4.15Å; F52-V144 HydrophobicContact CD2-CG1 3.75Å; F52-V144 HydrophobicContact CD2-CG2 4.06Å; F52-V144 HydrophobicContact CE2-CB 4.21Å; F52-V144 HydrophobicContact CE2-CG1 4.32Å; F52-V144 HydrophobicContact CE2-CG2 3.86Å; F52-V144 HydrophobicContact CG-CG1 4.33Å; F52-V144 HydrophobicContact CZ-CG2 4.32Å; S55-V144 WeakPolarHBondContact OG-CG1 3.25Å; Q57-V144 PolarHBondContact OE1-O 2.73Å; L107-V144 HydrophobicContact CD1-CG1 4.27Å; V142-V144 PolarHBondContact O-N 2.77Å; V144-V154 HydrophobicContact CB-CB 4.27Å; V144-V154 HydrophobicContact CB-CG1 4.47Å; V144-V154 HydrophobicContact CG2-CB 4.06Å; V144-V154 HydrophobicContact CG2-CG1 3.76Å; V144-V154 PolarHBondContact N-O 2.9Å; V144-C156 HydrophobicContact CG2-CB 3.91Å; V144-C156 WeakPolarHBondContact CG2-SG 3.4Å; V144-C161 WeakPolarHBondContact CG2-SG 3.44Å
145	A	59.1	Low	60.6	Low	4 Å²	4	52.4 Å²	52.4	3%	0.033	28%	0.283	C	S	.	.			trans	-146.5	154	176.5	0	0	0	0	0	109.8	Q57 L107 L147 N152	Q57-A145 HydrophobicContact CB-CB 4.07Å; L107-A145 HydrophobicContact CB-CB 4.19Å; L107-A145 HydrophobicContact CD1-CB 3.91Å; L107-A145 HydrophobicContact CD2-CB 3.96Å; L107-A145 HydrophobicContact CG-CB 4.23Å; A145-L147 HydrophobicContact CB-CD1 4.45Å; A145-N152 PolarHBondContact O-OD1 3.08Å
146	R	58.3	Low	60.6	Low	74 Å²	74	47 Å²	47	28%	0.279	26%	0.264	S	S	.	.			trans	-114.8	104.7	170.1	-172.8	172.9	-177.1	154.5	-4.2	107.5	G36 D150 N152	G36-R146 VanDerWaalsContact CA-NH1 3.26Å; R146-D150 IonicContact CZ-OD1 2.78Å; R146-D150 IonicContact CZ-OD2 3.45Å; R146-D150 IonicContact NE-OD1 2.72Å; R146-D150 PolarHBondContact NE-OD1 3.11Å; R146-D150 IonicContact NH2-OD1 3.68Å; R146-D150 PolarHBondContact NH2-OD1 3.16Å; R146-D150 IonicContact NH2-OD2 2.94Å; R146-D150 PolarHBondContact NH2-OD2 3.33Å; R146-N152 VanDerWaalsContact CA-OD1 3.32Å; R146-N152 WeakPolarHBondContact CA-OD1 3.08Å; R146-N152 WeakPolarHBondContact CG-OD1 2.89Å
147	L	59.3	Low	60.5	Low	5 Å²	5	48 Å²	48	3%	0.026	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-78.8	167	171.2	-79.4	98.8	0	0	0	109.6	G105 L107 A145 D150 W151 P153 L170	G105-L147 WeakPolarHBondContact O-CD2 3.21Å; L107-L147 HydrophobicContact CB-CD1 4.16Å; A145-L147 HydrophobicContact CB-CD1 4.45Å; L147-D150 PolarHBondContact O-N 2.64Å; L147-W151 HydrophobicContact CB-CB 4.47Å; L147-W151 HydrophobicContact CB-CE3 3.82Å; L147-W151 WeakPolarHBondContact CB-O 2.81Å; L147-W151 HydrophobicContact CD1-CE3 3.83Å; L147-W151 HydrophobicContact CD1-CZ3 3.95Å; L147-W151 HydrophobicContact CD2-CE3 3.95Å; L147-W151 HydrophobicContact CD2-CZ3 3.91Å; L147-W151 HydrophobicContact CG-CE3 4.08Å; L147-W151 HydrophobicContact CG-CZ3 4.37Å; L147-W151 PolarHBondContact N-O 3.13Å; L147-W151 PolarHBondContact O-N 3.02Å; L147-P153 HydrophobicContact CD1-CG 3.5Å; L147-P153 VanDerWaalsContact CD1-CG 3.5Å; L147-L170 VanDerWaalsContact CD2-C 3.46Å
148	P	56.8	Low	60.6	Low	14 Å²	14	46.8 Å²	46.8	9%	0.091	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-50	150.3	176.2	-30	40	0	0	0	111.4	S103 D150 Q173	S103-P148 VanDerWaalsContact OG-CG 3.25Å; S103-P148 WeakPolarHBondContact OG-CG 3.5Å; P148-D150 VanDerWaalsContact C-N 3.32Å; P148-Q173 HydrophobicContact CB-CB 4.31Å; P148-Q173 PolarHBondContact O-NE2 3.01Å; P148-Q173 VanDerWaalsContact O-NE2 3.13Å
149	S	54.6	Low	60.7	Low	42 Å²	42	43.3 Å²	43.3	29%	0.294	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	70.2	20.7	-174.1	-112.3	0	0	0	0	115.4	W151 Q173	S149-W151 PolarHBondContact O-N 2.77Å; S149-W151 VanDerWaalsContact O-N 3.12Å; S149-Q173 PolarHBondContact OG-OE1 2.95Å
150	D	58	Low	61.1	Low	89 Å²	89	41.7 Å²	41.7	48%	0.476	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	58.9	24.7	-176.8	-59.3	-19.7	0	0	0	112.8	R146 L147 P148 N152	R146-D150 IonicContact CZ-OD1 2.78Å; R146-D150 IonicContact CZ-OD2 3.45Å; R146-D150 IonicContact NE-OD1 2.72Å; R146-D150 PolarHBondContact NE-OD1 3.11Å; R146-D150 IonicContact NH2-OD1 3.68Å; R146-D150 PolarHBondContact NH2-OD1 3.16Å; R146-D150 IonicContact NH2-OD2 2.94Å; R146-D150 PolarHBondContact NH2-OD2 3.33Å; L147-D150 PolarHBondContact O-N 2.64Å; P148-D150 VanDerWaalsContact C-N 3.32Å; D150-N152 PolarHBondContact O-N 2.9Å
151	W	57.9	Low	61.3	Low	57 Å²	57	37.1 Å²	37.1	22%	0.216	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-77.3	113.5	176.3	-175	67.4	0	0	0	109.6	L147 S149 P153 I217 L222	L147-W151 HydrophobicContact CB-CB 4.47Å; L147-W151 HydrophobicContact CB-CE3 3.82Å; L147-W151 WeakPolarHBondContact CB-O 2.81Å; L147-W151 HydrophobicContact CD1-CE3 3.83Å; L147-W151 HydrophobicContact CD1-CZ3 3.95Å; L147-W151 HydrophobicContact CD2-CE3 3.95Å; L147-W151 HydrophobicContact CD2-CZ3 3.91Å; L147-W151 HydrophobicContact CG-CE3 4.08Å; L147-W151 HydrophobicContact CG-CZ3 4.37Å; L147-W151 PolarHBondContact N-O 3.13Å; L147-W151 PolarHBondContact O-N 3.02Å; S149-W151 PolarHBondContact O-N 2.77Å; S149-W151 VanDerWaalsContact O-N 3.12Å; W151-P153 HydrophobicContact CE3-CB 4.29Å; W151-P153 HydrophobicContact CE3-CG 4.41Å; W151-P153 HydrophobicContact CH2-CB 3.59Å; W151-P153 HydrophobicContact CH2-CG 4.38Å; W151-P153 HydrophobicContact CZ2-CB 3.83Å; W151-P153 HydrophobicContact CZ3-CB 3.82Å; W151-P153 HydrophobicContact CZ3-CG 4.12Å; W151-P153 WeakPolarHBondContact O-CD 3.26Å; W151-I217 HydrophobicContact CB-CD1 3.89Å; W151-I217 HydrophobicContact CD2-CD1 4.2Å; W151-I217 HydrophobicContact CD2-CG2 3.6Å; W151-I217 HydrophobicContact CE3-CG2 3.59Å; W151-I217 HydrophobicContact CG-CD1 3.81Å; W151-I217 HydrophobicContact CG-CG2 4.3Å; W151-I217 HydrophobicContact CH2-CG2 3.62Å; W151-I217 HydrophobicContact CZ2-CG2 3.63Å; W151-I217 HydrophobicContact CZ3-CG2 3.62Å; W151-L222 HydrophobicContact CH2-CD2 3.89Å; W151-L222 HydrophobicContact CZ2-CD1 4.36Å; W151-L222 HydrophobicContact CZ2-CD2 3.62Å
152	N	64.5	Low	61.4	Low	35 Å²	35	35.6 Å²	35.6	19%	0.187	18%	0.176	C	C	.	.			trans	-107.8	101	178.5	-63.2	-26	0	0	0	108.6	A145 R146 D150 V154 Y155	A145-N152 PolarHBondContact O-OD1 3.08Å; R146-N152 VanDerWaalsContact CA-OD1 3.32Å; R146-N152 WeakPolarHBondContact CA-OD1 3.08Å; R146-N152 WeakPolarHBondContact CG-OD1 2.89Å; D150-N152 PolarHBondContact O-N 2.9Å; N152-V154 VanDerWaalsContact C-N 3.34Å; N152-V154 PolarHBondContact O-N 3.38Å; N152-Y155 HydrophobicContact CB-CE1 4.19Å; N152-Y155 HydrophobicContact CB-CE2 4.09Å; N152-Y155 WeakPolarHBondContact CB-OH 3.3Å; N152-Y155 PolarHBondContact ND2-OH 2.83Å
153	P	60.9	Low	61.2	Low	5 Å²	5	35.1 Å²	35.1	3%	0.032	17%	0.174	C	C	.	.			trans	-72.8	-27.1	-173.3	27.7	-36.6	0	0	0	113.5	L107 L147 W151 L222 N223	L107-P153 HydrophobicContact CD2-CG 3.58Å; L147-P153 HydrophobicContact CD1-CG 3.5Å; L147-P153 VanDerWaalsContact CD1-CG 3.5Å; W151-P153 HydrophobicContact CE3-CB 4.29Å; W151-P153 HydrophobicContact CE3-CG 4.41Å; W151-P153 HydrophobicContact CH2-CB 3.59Å; W151-P153 HydrophobicContact CH2-CG 4.38Å; W151-P153 HydrophobicContact CZ2-CB 3.83Å; W151-P153 HydrophobicContact CZ3-CB 3.82Å; W151-P153 HydrophobicContact CZ3-CG 4.12Å; W151-P153 WeakPolarHBondContact O-CD 3.26Å; P153-L222 HydrophobicContact CB-CD2 3.58Å; P153-N223 PolarHBondContact O-OD1 3Å
154	V	63.8	Low	61.2	Low	9 Å²	9	40.4 Å²	40.4	6%	0.055	20%	0.195	C	C	.	.			trans	-138.6	131.8	-172.3	-175.1	0	0	0	0	110	L107 S143 V144 N152 T167	L107-V154 HydrophobicContact CD2-CG2 4.17Å; S143-V154 WeakPolarHBondContact CA-O 3.43Å; V144-V154 HydrophobicContact CB-CB 4.27Å; V144-V154 HydrophobicContact CB-CG1 4.47Å; V144-V154 HydrophobicContact CG2-CB 4.06Å; V144-V154 HydrophobicContact CG2-CG1 3.76Å; V144-V154 PolarHBondContact N-O 2.9Å; N152-V154 VanDerWaalsContact C-N 3.34Å; N152-V154 PolarHBondContact O-N 3.38Å; V154-T167 HydrophobicContact CG2-CG2 3.56Å
155	Y	67.8	Low	61.3	Low	117 Å²	117	42 Å²	42	46%	0.459	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.3	170.8	-64	-90	0	0	0	109.5	V142 N152	V142-Y155 WeakPolarHBondContact O-CA 3.34Å; N152-Y155 HydrophobicContact CB-CE1 4.19Å; N152-Y155 HydrophobicContact CB-CE2 4.09Å; N152-Y155 WeakPolarHBondContact CB-OH 3.3Å; N152-Y155 PolarHBondContact ND2-OH 2.83Å
156	C	65.8	Low	61.4	Low	17 Å²	17	44.7 Å²	44.7	12%	0.115	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.5	-179.5	-68.1	0	0	0	0	112.4	F52 P141 V142 V144 C161	F52-C156 HydrophobicContact CE1-CB 4.04Å; F52-C156 HydrophobicContact CZ-CB 3.94Å; P141-C156 CarbonylContact C-O 3.35Å; V142-C156 PolarHBondContact N-O 2.85Å; V142-C156 PolarHBondContact O-N 2.84Å; V144-C156 HydrophobicContact CG2-CB 3.91Å; V144-C156 WeakPolarHBondContact CG2-SG 3.4Å; C156-C161 HydrophobicContact CB-CB 3.97Å; C156-C161 WeakPolarHBondContact CB-SG 3.44Å; C156-C161 WeakPolarHBondContact SG-CB 3.45Å; C156-C161 CovalentContact SG-SG 2.02Å; C156-C161 PolarHBondContact SG-SG 3.33Å
157	R	65.7	Low	61.7	Low	119 Å²	119	41.2 Å²	41.2	45%	0.449	21%	0.21	S	C	.	.			trans	-78.9	132.8	163	-77.7	-175.5	173.2	108.7	-0.9	110.5
158	P	62.2	Low	62.1	Low	26 Å²	26	44.4 Å²	44.4	17%	0.169	23%	0.227	C	C	.	.	S	Bend	trans	-62.3	158.4	168.3	28.9	-35.2	0	0	0	110.5	N137	N137-P158 WeakPolarHBondContact ND2-CG 3.09Å
159	P	60.4	Low	62.6	Low	52 Å²	52	43.8 Å²	43.8	34%	0.338	22%	0.223	S	C	.	.	S	Bend	cis	-87.7	-22	7.5	32.1	-36.2	0	0	0	115.2	F130	F130-P159 HydrophobicContact CD1-CG 3.43Å; F130-P159 VanDerWaalsContact CD1-CG 3.43Å; F130-P159 HydrophobicContact CE1-CB 4.17Å; F130-P159 HydrophobicContact CE1-CG 3.3Å
160	I	63.9	Low	63.2	Low	10 Å²	10	44 Å²	44	5%	0.051	22%	0.22	C	C	.	.			trans	-134.6	135.7	-176.7	-69.5	-172.2	0	0	0	110.2	P53 L54 M124 R134	P53-I160 HydrophobicContact CG-CD1 3.85Å; P53-I160 HydrophobicContact CG-CG1 3.95Å; L54-I160 HydrophobicContact CD1-CG2 4.02Å; M124-I160 HydrophobicContact CE-CD1 3.15Å; M124-I160 HydrophobicContact CE-CG1 4.21Å; M124-I160 HydrophobicContact CG-CD1 4.44Å; M124-I160 HydrophobicContact SD-CD1 3.35Å; M124-I160 WeakPolarHBondContact SD-CD1 3.19Å; R134-I160 PolarHBondContact NH2-O 3.24Å
161	C	62.7	Low	63.4	Low	5 Å²	5	39.7 Å²	39.7	3%	0.034	20%	0.198	C	C	.	.			trans	-75	160.2	167.2	-69.1	0	0	0	0	112.6	F52 R109 V144 C156 P163	F52-C161 HydrophobicContact CD1-CB 4.41Å; R109-C161 PolarHBondContact NH2-O 3.38Å; V144-C161 WeakPolarHBondContact CG2-SG 3.44Å; C156-C161 HydrophobicContact CB-CB 3.97Å; C156-C161 WeakPolarHBondContact CB-SG 3.44Å; C156-C161 WeakPolarHBondContact SG-CB 3.45Å; C156-C161 CovalentContact SG-SG 2.02Å; C156-C161 PolarHBondContact SG-SG 3.33Å; C161-P163 VanDerWaalsContact O-CD 3.28Å; C161-P163 WeakPolarHBondContact O-CD 3.13Å; C161-P163 VanDerWaalsContact O-N 3.15Å
162	N	63.7	Low	63.9	Low	33 Å²	33	38.5 Å²	38.5	18%	0.176	20%	0.196	C	C	.	.			trans	-59.6	109.8	174.3	-178.6	2.2	0	0	0	112.8	R109 F164 V165 S224	R109-N162 VanDerWaalsContact CZ-O 3.26Å; R109-N162 PolarHBondContact NE-O 2.94Å; R109-N162 PolarHBondContact NH2-O 2.91Å; N162-F164 VanDerWaalsContact C-N 3.27Å; N162-F164 PolarHBondContact O-N 3.46Å; N162-F164 VanDerWaalsContact OD1-CD2 3.27Å; N162-F164 WeakPolarHBondContact OD1-CD2 3.38Å; N162-F164 PolarHBondContact OD1-N 3.1Å; N162-F164 VanDerWaalsContact OD1-N 3.16Å; N162-V165 HydrophobicContact CB-CG2 4.31Å; N162-V165 WeakPolarHBondContact O-CG2 3.49Å; N162-S224 PolarHBondContact ND2-OG 2.87Å
163	P	58.4	Low	63.7	Low	10 Å²	10	36.9 Å²	36.9	7%	0.065	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-14.3	-173.9	31.4	-34.8	0	0	0	114.2	L54 R109 P110 I121 M125 C161 V165	L54-P163 HydrophobicContact CD1-CB 3.71Å; L54-P163 HydrophobicContact CD1-CG 4.27Å; R109-P163 VanDerWaalsContact NH2-N 3.17Å; P110-P163 WeakPolarHBondContact CB-O 3.49Å; P110-P163 WeakPolarHBondContact CG-O 3.29Å; I121-P163 HydrophobicContact CG2-CB 4.33Å; I121-P163 HydrophobicContact CG2-CG 3.68Å; M125-P163 WeakPolarHBondContact SD-CD 3.4Å; M125-P163 HydrophobicContact SD-CG 3.56Å; M125-P163 VanDerWaalsContact SD-CG 3.56Å; C161-P163 VanDerWaalsContact O-CD 3.28Å; C161-P163 WeakPolarHBondContact O-CD 3.13Å; C161-P163 VanDerWaalsContact O-N 3.15Å; P163-V165 VanDerWaalsContact C-N 3.31Å; P163-V165 PolarHBondContact O-N 3.09Å
164	F	60.7	Low	63.9	Low	121 Å²	121	38.5 Å²	38.5	53%	0.531	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.2	-175.2	-55.5	-62.6	0	0	0	113.8	M122 M125 N162	M122-F164 HydrophobicContact CE-CE1 3.5Å; M122-F164 HydrophobicContact CE-CE2 3.95Å; M122-F164 HydrophobicContact CE-CZ 3.13Å; M122-F164 HydrophobicContact CG-CZ 4.48Å; M122-F164 HydrophobicContact SD-CE1 4.37Å; M122-F164 HydrophobicContact SD-CE2 4.02Å; M122-F164 HydrophobicContact SD-CZ 3.45Å; M122-F164 WeakPolarHBondContact SD-CZ 3.32Å; M125-F164 HydrophobicContact CE-CD2 4.32Å; M125-F164 HydrophobicContact CE-CE2 3.87Å; M125-F164 HydrophobicContact SD-CD2 4.37Å; M125-F164 HydrophobicContact SD-CE2 3.54Å; M125-F164 VanDerWaalsContact SD-CE2 3.54Å; M125-F164 HydrophobicContact SD-CZ 4.17Å; N162-F164 VanDerWaalsContact C-N 3.27Å; N162-F164 PolarHBondContact O-N 3.46Å; N162-F164 VanDerWaalsContact OD1-CD2 3.27Å; N162-F164 WeakPolarHBondContact OD1-CD2 3.38Å; N162-F164 PolarHBondContact OD1-N 3.1Å; N162-F164 VanDerWaalsContact OD1-N 3.16Å
165	V	61.8	Low	63.8	Low	38 Å²	38	38.8 Å²	38.8	23%	0.23	20%	0.202	C	C	.	.	S	Bend	trans	-89.2	115.5	168.3	-74.4	0	0	0	0	109.5	N162 P163	N162-V165 HydrophobicContact CB-CG2 4.31Å; N162-V165 WeakPolarHBondContact O-CG2 3.49Å; P163-V165 VanDerWaalsContact C-N 3.31Å; P163-V165 PolarHBondContact O-N 3.09Å
166	S	61.8	Low	63.6	Low	60 Å²	60	39.6 Å²	39.6	42%	0.42	21%	0.21	S	C	.	.			trans	-67	132.5	159.3	53.5	0	0	0	0	107.4	R109 H221	R109-S166 CarbonylContact O-C 3.29Å; R109-S166 VanDerWaalsContact O-CA 3.25Å; R109-S166 WeakPolarHBondContact O-CA 3.14Å; S166-H221 WeakPolarHBondContact O-CB 3.09Å
167	T	65.1	Low	63.2	Low	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	130.1	170.9	-55.3	0	0	0	0	107.3	R109 V154 Q220 H221	R109-T167 PolarHBondContact N-O 3.23Å; R109-T167 PolarHBondContact O-N 2.93Å; V154-T167 HydrophobicContact CG2-CG2 3.56Å; T167-Q220 WeakPolarHBondContact CA-O 3.41Å; T167-H221 WeakPolarHBondContact CG2-O 3.19Å; T167-H221 PolarHBondContact OG1-O 3.02Å
168	I	67.5	Low	62.7	Low	73 Å²	73	40.8 Å²	40.8	37%	0.374	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.3	174.4	-60.4	174	0	0	0	106.7	L107 G219 Q220	L107-I168 WeakPolarHBondContact O-CA 3.19Å; I168-G219 WeakPolarHBondContact O-CA 3.2Å; I168-Q220 PolarHBondContact N-O 2.96Å; I168-Q220 VanDerWaalsContact N-O 3.09Å; I168-Q220 PolarHBondContact O-N 3.03Å
169	G	66.4	Low	62.4	Low	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.5	172	0	0	0	0	0	109.4	H106 L107	H106-G169 CarbonylContact C-O 3.59Å; H106-G169 VanDerWaalsContact CA-O 3.25Å; H106-G169 WeakPolarHBondContact CA-O 3.46Å; L107-G169 PolarHBondContact N-O 2.94Å; L107-G169 PolarHBondContact O-N 3.28Å
170	L	67.6	Low	62.3	Low	46 Å²	46	42 Å²	42	24%	0.241	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.7	175.4	179.1	69.1	0	0	0	108	Y104 H106 L147 F216 I217 Y218	Y104-L170 HydrophobicContact CD2-CD1 4.43Å; Y104-L170 HydrophobicContact CE2-CD1 3.55Å; H106-L170 HydrophobicContact CB-CD1 4.14Å; L147-L170 VanDerWaalsContact CD2-C 3.46Å; L170-F216 HydrophobicContact CD2-CE1 4.33Å; L170-I217 WeakPolarHBondContact O-CA 3.25Å; L170-Y218 PolarHBondContact N-O 3.09Å; L170-Y218 PolarHBondContact O-N 3.01Å
171	G	63.4	Low	62	Low	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	123.2	179.5	0	0	0	0	0	109.3	G105 F216	G105-G171 PolarHBondContact N-O 2.65Å; G105-G171 PolarHBondContact O-N 3.45Å; G171-F216 WeakPolarHBondContact CA-O 3.32Å
172	V	67.9	Low	61.7	Low	32 Å²	32	45 Å²	45	19%	0.194	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.7	173.7	-53.7	0	0	0	0	109.4	S103 Y104 F216	S103-V172 WeakPolarHBondContact O-CA 3.3Å; Y104-V172 HydrophobicContact CD2-CG1 3.61Å; Y104-V172 HydrophobicContact CE2-CG1 4.21Å; V172-F216 HydrophobicContact CG2-CB 3.64Å; V172-F216 HydrophobicContact CG2-CD1 4.02Å; V172-F216 HydrophobicContact CG2-CG 4.29Å; V172-F216 PolarHBondContact N-O 2.84Å; V172-F216 PolarHBondContact O-N 2.84Å
173	Q	59.5	Low	61.2	Low	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	134.8	175.9	-104.8	152	104.1	0	0	109.5	W101 Y102 S103 P148 S149 L215	W101-Q173 HydrophobicContact CH2-CB 3.88Å; W101-Q173 HydrophobicContact CH2-CG 4.37Å; W101-Q173 HydrophobicContact CZ3-CB 3.68Å; Y102-Q173 CarbonylContact C-O 3.59Å; Y102-Q173 WeakPolarHBondContact CA-O 2.97Å; Y102-Q173 WeakPolarHBondContact CD2-O 3.05Å; S103-Q173 PolarHBondContact N-O 3.21Å; S103-Q173 PolarHBondContact O-N 3.44Å; P148-Q173 HydrophobicContact CB-CB 4.31Å; P148-Q173 PolarHBondContact O-NE2 3.01Å; P148-Q173 VanDerWaalsContact O-NE2 3.13Å; S149-Q173 PolarHBondContact OG-OE1 2.95Å; Q173-L215 VanDerWaalsContact CD-CD1 3.46Å; Q173-L215 HydrophobicContact CG-CB 4.19Å; Q173-L215 HydrophobicContact CG-CD1 3.51Å; Q173-L215 HydrophobicContact CG-CG 4.46Å
174	A	64.7	Low	60.9	Low	38 Å²	38	44.2 Å²	44.2	31%	0.314	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.5	168.7	0	0	0	0	0	108	Y102 P213 P214	Y102-A174 HydrophobicContact CD2-CB 3.96Å; A174-P213 WeakPolarHBondContact O-CA 3.38Å; A174-P213 WeakPolarHBondContact O-CB 3.36Å; A174-P214 HydrophobicContact CB-CG 4.35Å; A174-P214 PolarHBondContact N-O 2.82Å; A174-P214 WeakPolarHBondContact O-CD 3.33Å
175	Q	63.5	Low	60.4	Low	16 Å²	16	39.5 Å²	39.5	8%	0.075	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	125.9	173.3	-178	59.2	74.3	0	0	109.1	P100 W101 N179 P213	P100-Q175 VanDerWaalsContact CA-O 3.25Å; P100-Q175 WeakPolarHBondContact CA-O 3.14Å; W101-Q175 HydrophobicContact CD2-CB 3.95Å; W101-Q175 VanDerWaalsContact CE2-CB 3.49Å; W101-Q175 HydrophobicContact CG-CB 4.24Å; W101-Q175 HydrophobicContact CZ2-CB 3.83Å; W101-Q175 PolarHBondContact N-O 2.78Å; W101-Q175 VanDerWaalsContact N-O 3.07Å; W101-Q175 PolarHBondContact O-N 3.22Å; Q175-N179 PolarHBondContact NE2-ND2 3.31Å; Q175-N179 PolarHBondContact OE1-ND2 3.46Å; Q175-N179 VanDerWaalsContact OE1-ND2 3.1Å; Q175-P213 HydrophobicContact CB-CB 4.07Å; Q175-P213 VanDerWaalsContact OE1-CG 3.27Å
176	E	62	Low	60.3	Low	133 Å²	133	40.8 Å²	40.8	62%	0.621	23%	0.229	S	C	*	.			trans	-84.7	161.5	171.8	-64.6	-172.1	172.1	0	0	111.7	V178	E176-V178 HydrophobicContact CB-CG2 4.38Å; E176-V178 PolarHBondContact O-N 2.69Å
177	S	57.2	Low	59.9	Low	62 Å²	62	38.5 Å²	38.5	43%	0.434	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	12.2	-171.2	71.7	0	0	0	0	115.5	N98 N179	N98-S177 VanDerWaalsContact O-CA 3.25Å; N98-S177 WeakPolarHBondContact O-CA 2.83Å; N98-S177 WeakPolarHBondContact O-CB 3.41Å; S177-N179 VanDerWaalsContact C-N 3.31Å
178	V	56.1	Low	59.9	Low	100 Å²	100	41.5 Å²	41.5	61%	0.606	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-8	-170.5	-167	0	0	0	0	111.8	E176	E176-V178 HydrophobicContact CB-CG2 4.38Å; E176-V178 PolarHBondContact O-N 2.69Å
179	N	56.9	Low	59.7	Low	16 Å²	16	39.2 Å²	39.2	9%	0.086	22%	0.215	C	C	.	.			trans	-84.5	135	-175	-69.8	3.4	0	0	0	111.6	T97 N98 Q175 S177 G210 Q211	T97-N179 WeakPolarHBondContact CA-O 3.46Å; N98-N179 PolarHBondContact N-O 2.64Å; Q175-N179 PolarHBondContact NE2-ND2 3.31Å; Q175-N179 PolarHBondContact OE1-ND2 3.46Å; Q175-N179 VanDerWaalsContact OE1-ND2 3.1Å; S177-N179 VanDerWaalsContact C-N 3.31Å; N179-G210 VanDerWaalsContact OD1-CA 3.27Å; N179-G210 WeakPolarHBondContact OD1-CA 3.37Å; N179-Q211 PolarHBondContact ND2-O 3.31Å; N179-Q211 PolarHBondContact OD1-N 2.92Å; N179-Q211 PolarHBondContact OD1-O 2.84Å
180	Y	56.6	Low	59.6	Low	88 Å²	88	43.2 Å²	43.2	35%	0.345	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.4	175.2	178.2	-105.1	0	0	0	109.6	S95 G96 I182 F209	S95-Y180 WeakPolarHBondContact CB-OH 3.49Å; S95-Y180 WeakPolarHBondContact OG-CE2 3.46Å; S95-Y180 VanDerWaalsContact OG-CZ 3.31Å; S95-Y180 PolarHBondContact OG-OH 3.09Å; G96-Y180 WeakPolarHBondContact O-CA 3.46Å; G96-Y180 WeakPolarHBondContact O-CD2 2.91Å; Y180-I182 HydrophobicContact CD1-CD1 4.44Å; Y180-I182 HydrophobicContact CD1-CG1 4.11Å; Y180-I182 HydrophobicContact CE1-CD1 3.53Å; Y180-I182 HydrophobicContact CE1-CG1 3.31Å; Y180-F209 HydrophobicContact CD1-CD2 4.28Å; Y180-F209 PolarHBondContact N-O 2.76Å; Y180-F209 PolarHBondContact O-N 3.42Å
181	I	58.7	Low	59.3	Low	19 Å²	19	46.8 Å²	46.8	10%	0.097	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.5	177.5	-57	-179.7	0	0	0	108.2	S95 G96 N98 Y208	S95-I181 VanDerWaalsContact CA-O 3.31Å; S95-I181 WeakPolarHBondContact CA-O 3.43Å; G96-I181 PolarHBondContact N-O 2.91Å; G96-I181 PolarHBondContact O-N 3.38Å; N98-I181 VanDerWaalsContact ND2-CD1 3.34Å; N98-I181 WeakPolarHBondContact ND2-CD1 3.14Å; N98-I181 WeakPolarHBondContact OD1-CD1 2.88Å; N98-I181 WeakPolarHBondContact OD1-CG1 3.11Å; I181-Y208 HydrophobicContact CB-CE1 4.45Å; I181-Y208 HydrophobicContact CD1-CD1 3.89Å; I181-Y208 HydrophobicContact CD1-CE1 3.32Å; I181-Y208 HydrophobicContact CG1-CD1 3.61Å; I181-Y208 HydrophobicContact CG1-CE1 3.57Å; I181-Y208 HydrophobicContact CG2-CD1 4.4Å; I181-Y208 HydrophobicContact CG2-CE1 4.07Å
182	I	57.3	Low	59.2	Low	57 Å²	57	51.2 Å²	51.2	29%	0.292	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.4	159.9	-59.5	167.7	0	0	0	107.6	L93 T94 Y180 T206 G207 F209	L93-I182 HydrophobicContact CD1-CG2 3.7Å; T94-I182 CarbonylContact O-C 3.49Å; T94-I182 VanDerWaalsContact O-CA 3.3Å; T94-I182 WeakPolarHBondContact O-CA 3.4Å; Y180-I182 HydrophobicContact CD1-CD1 4.44Å; Y180-I182 HydrophobicContact CD1-CG1 4.11Å; Y180-I182 HydrophobicContact CE1-CD1 3.53Å; Y180-I182 HydrophobicContact CE1-CG1 3.31Å; I182-T206 CarbonylContact O-C 3.52Å; I182-T206 WeakPolarHBondContact O-CA 3.21Å; I182-G207 PolarHBondContact N-O 2.82Å; I182-G207 PolarHBondContact O-N 3.07Å; I182-F209 HydrophobicContact CD1-CE2 4.17Å
183	D	52.5	Low	58.7	Low	8 Å²	8	50 Å²	50	4%	0.043	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.2	167.3	-175	22.4	0	0	0	109.6	P25 Y92 L93 T94 T206	P25-D183 HydrophobicContact CB-CB 4.46Å; P25-D183 WeakPolarHBondContact CB-OD2 3.31Å; P25-D183 HydrophobicContact CG-CB 3.76Å; P25-D183 WeakPolarHBondContact CG-OD2 3.1Å; Y92-D183 HydrophobicContact CE2-CB 4.44Å; Y92-D183 WeakPolarHBondContact CE2-OD2 3.25Å; Y92-D183 PolarHBondContact OH-OD2 2.96Å; L93-D183 CarbonylContact C-O 3.52Å; L93-D183 WeakPolarHBondContact CA-O 3.36Å; T94-D183 PolarHBondContact N-O 2.79Å; T94-D183 PolarHBondContact O-N 3Å; D183-T206 HydrophobicContact CB-CG2 4.09Å; D183-T206 WeakPolarHBondContact OD1-CG2 3.31Å
184	G	51.2	Low	58.7	Low	19 Å²	19	53.7 Å²	53.7	20%	0.196	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.7	173.1	0	0	0	0	0	110	Y92 S204 G205	Y92-G184 VanDerWaalsContact O-CA 3.32Å; Y92-G184 WeakPolarHBondContact O-CA 3.17Å; G184-S204 VanDerWaalsContact O-CA 3.29Å; G184-S204 WeakPolarHBondContact O-CA 3.27Å; G184-G205 PolarHBondContact N-O 2.91Å; G184-G205 PolarHBondContact O-N 2.79Å
185	L	51.8	Low	58.3	Low	23 Å²	23	60 Å²	60	12%	0.12	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.3	162.1	175.7	68.8	0	0	0	108.1	Y22 G91 Y92 P202	Y22-L185 HydrophobicContact CD1-CD2 4.06Å; Y22-L185 HydrophobicContact CE1-CD2 3.88Å; G91-L185 CarbonylContact C-O 3.51Å; G91-L185 WeakPolarHBondContact CA-O 3.4Å; Y92-L185 HydrophobicContact CD1-CB 3.64Å; Y92-L185 HydrophobicContact CD1-CD2 3.99Å; Y92-L185 HydrophobicContact CD1-CG 4.37Å; Y92-L185 HydrophobicContact CD2-CB 4.47Å; Y92-L185 HydrophobicContact CE1-CB 3.21Å; Y92-L185 HydrophobicContact CE1-CD2 3.45Å; Y92-L185 VanDerWaalsContact CE1-CD2 3.45Å; Y92-L185 HydrophobicContact CE1-CG 3.95Å; Y92-L185 HydrophobicContact CE2-CB 4.1Å; Y92-L185 HydrophobicContact CG-CB 4.25Å; Y92-L185 VanDerWaalsContact CZ-CB 3.44Å; Y92-L185 PolarHBondContact N-O 2.95Å; Y92-L185 PolarHBondContact O-N 2.81Å; L185-P202 HydrophobicContact CD1-CB 3.74Å
186	L	59	Low	57.9	Low	65 Å²	65	60.7 Å²	60.7	34%	0.34	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	106.3	170.3	-169.9	57.3	0	0	0	108.3	I89 K90 F188 L203	I89-L186 HydrophobicContact CG2-CD1 3.77Å; K90-L186 CarbonylContact O-C 3.55Å; K90-L186 WeakPolarHBondContact O-CA 3.3Å; L186-F188 HydrophobicContact CB-CE2 4.28Å; L186-F188 HydrophobicContact CB-CZ 4.1Å; L186-F188 HydrophobicContact CD1-CD1 4.45Å; L186-F188 HydrophobicContact CD1-CE1 3.93Å; L186-F188 HydrophobicContact CD1-CZ 4.31Å; L186-F188 HydrophobicContact CD2-CD1 4.47Å; L186-F188 HydrophobicContact CD2-CE1 3.33Å; L186-F188 HydrophobicContact CD2-CE2 3.99Å; L186-F188 HydrophobicContact CD2-CZ 3.06Å; L186-F188 HydrophobicContact CG-CD1 4.03Å; L186-F188 HydrophobicContact CG-CD2 4.45Å; L186-F188 HydrophobicContact CG-CE1 3.3Å; L186-F188 HydrophobicContact CG-CE2 3.78Å; L186-F188 HydrophobicContact CG-CZ 3.2Å; L186-L203 PolarHBondContact N-O 2.86Å; L186-L203 PolarHBondContact O-N 3.1Å
187	D	53.7	Low	57.4	Low	11 Å²	11	58.7 Å²	58.7	6%	0.059	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.2	176.5	178.6	24.1	0	0	0	109.1	I89 K90 R200	I89-D187 WeakPolarHBondContact CA-O 3.33Å; K90-D187 HydrophobicContact CB-CB 4.4Å; K90-D187 PolarHBondContact N-O 2.76Å; K90-D187 PolarHBondContact O-N 2.89Å; D187-R200 WeakPolarHBondContact OD1-CB 2.96Å; D187-R200 WeakPolarHBondContact OD2-CD 3.49Å; D187-R200 IonicContact OD2-CZ 3.47Å; D187-R200 IonicContact OD2-NH1 3.85Å; D187-R200 PolarHBondContact OD2-NH1 3.17Å
188	F	64.4	Low	57.3	Low	64 Å²	64	57.8 Å²	57.8	28%	0.281	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	141	174.5	-35.7	-94	0	0	0	110.4	I89 L186 I190 Y201 L203	I89-F188 HydrophobicContact CD1-CD1 4.4Å; I89-F188 HydrophobicContact CG1-CD1 4.22Å; I89-F188 HydrophobicContact CG2-CD1 3.95Å; I89-F188 HydrophobicContact CG2-CE1 4.45Å; L186-F188 HydrophobicContact CB-CE2 4.28Å; L186-F188 HydrophobicContact CB-CZ 4.1Å; L186-F188 HydrophobicContact CD1-CD1 4.45Å; L186-F188 HydrophobicContact CD1-CE1 3.93Å; L186-F188 HydrophobicContact CD1-CZ 4.31Å; L186-F188 HydrophobicContact CD2-CD1 4.47Å; L186-F188 HydrophobicContact CD2-CE1 3.33Å; L186-F188 HydrophobicContact CD2-CE2 3.99Å; L186-F188 HydrophobicContact CD2-CZ 3.06Å; L186-F188 HydrophobicContact CG-CD1 4.03Å; L186-F188 HydrophobicContact CG-CD2 4.45Å; L186-F188 HydrophobicContact CG-CE1 3.3Å; L186-F188 HydrophobicContact CG-CE2 3.78Å; L186-F188 HydrophobicContact CG-CZ 3.2Å; F188-I190 PolarHBondContact O-N 2.77Å; F188-Y201 PolarHBondContact N-O 2.89Å; F188-Y201 PolarHBondContact O-N 2.79Å; F188-L203 HydrophobicContact CE2-CB 4.13Å; F188-L203 HydrophobicContact CE2-CD2 4.44Å
189	P	63.6	Low	57.3	Low	26 Å²	26	58 Å²	58	17%	0.169	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.2	169.3	3.9	10.4	0	0	0	110.8	W87 D88	W87-P189 HydrophobicContact CG-CG 4.27Å; W87-P189 PolarHBondContact NE1-O 2.74Å; W87-P189 VanDerWaalsContact NE1-O 3.09Å; D88-P189 WeakPolarHBondContact O-CD 3.3Å; D88-P189 WeakPolarHBondContact O-CG 3.34Å
190	I	64	Low	57.1	Low	83 Å²	83	62.8 Å²	62.8	43%	0.426	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	120.9	165.2	-57	178.7	0	0	0	108.1	F188 T192 G198 L199 Y201	F188-I190 PolarHBondContact O-N 2.77Å; I190-T192 PolarHBondContact O-N 2.84Å; I190-G198 CarbonylContact O-C 3.59Å; I190-G198 WeakPolarHBondContact O-CA 3.4Å; I190-L199 WeakPolarHBondContact CA-O 3.42Å; I190-L199 WeakPolarHBondContact CB-O 3.2Å; I190-L199 PolarHBondContact N-O 3.2Å; I190-L199 PolarHBondContact O-N 2.72Å; I190-Y201 HydrophobicContact CD1-CD2 4.42Å; I190-Y201 HydrophobicContact CD1-CG 4.19Å
191	R	61.3	Low	57.1	Low	122 Å²	122	64.8 Å²	64.8	46%	0.46	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	123.3	176.6	-173.7	178.1	-173	-93.9	7.6	110.5	G193 P194	R191-G193 PolarHBondContact NE-O 3.02Å; R191-G193 PolarHBondContact NH1-O 2.78Å; R191-G193 PolarHBondContact NH2-O 2.78Å; R191-P194 VanDerWaalsContact NH2-CA 3.3Å; R191-P194 PolarHBondContact NH2-O 2.83Å
192	T	61	Low	57	Low	92 Å²	92	67.6 Å²	67.6	56%	0.564	35%	0.352	S	S	*	.			trans	-104.2	-19	176.7	48.7	0	0	0	0	112.9	I190 E197 L199	I190-T192 PolarHBondContact O-N 2.84Å; T192-E197 PolarHBondContact N-O 3.3Å; T192-E197 PolarHBondContact OG1-O 3.27Å; T192-L199 HydrophobicContact CG2-CB 3.78Å
193	G	56.9	Low	57.1	Low	6 Å²	6	69.1 Å²	69.1	6%	0.062	36%	0.36	C	S	.	.	S	Bend	trans	-162.1	-178.7	-178.8	0	0	0	0	0	117.5	R191 Y195 E197	R191-G193 PolarHBondContact NE-O 3.02Å; R191-G193 PolarHBondContact NH1-O 2.78Å; R191-G193 PolarHBondContact NH2-O 2.78Å; G193-Y195 PolarHBondContact O-N 3.16Å; G193-E197 VanDerWaalsContact CA-OE1 3.3Å; G193-E197 WeakPolarHBondContact CA-OE1 3.25Å; G193-E197 VanDerWaalsContact N-CG 3.35Å; G193-E197 PolarHBondContact N-O 2.78Å
194	P	60.1	Low	57.2	Low	79 Å²	79	72.7 Å²	72.7	51%	0.513	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-30.8	-164.3	20.9	-31.1	0	0	0	115.5	R191 E197	R191-P194 VanDerWaalsContact NH2-CA 3.3Å; R191-P194 PolarHBondContact NH2-O 2.83Å; P194-E197 WeakPolarHBondContact CD-OE1 3.3Å
195	Y	56.6	Low	56.9	Low	170 Å²	170	74 Å²	74	67%	0.667	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	19.5	-169.9	-60.7	-77	0	0	0	114.7	G193 E197	G193-Y195 PolarHBondContact O-N 3.16Å; Y195-E197 WeakPolarHBondContact CB-OE2 3.32Å; Y195-E197 PolarHBondContact N-OE2 3.32Å
196	G	54.2	Low	56.7	Low	31 Å²	31	76.3 Å²	76.3	32%	0.32	41%	0.414	S	S	.	.	S	Bend	trans	88.5	7.2	-177.9	0	0	0	0	0	113.6	G198	G196-G198 PolarHBondContact O-N 2.82Å
197	E	52.2	Low	56.3	Low	91 Å²	91	74.3 Å²	74.3	43%	0.425	41%	0.41	S	S	.	.			trans	-60.4	130.4	164.4	62.5	-117.8	-144.9	0	0	110.8	T192 G193 P194 Y195	T192-E197 PolarHBondContact N-O 3.3Å; T192-E197 PolarHBondContact OG1-O 3.27Å; G193-E197 VanDerWaalsContact CA-OE1 3.3Å; G193-E197 WeakPolarHBondContact CA-OE1 3.25Å; G193-E197 VanDerWaalsContact N-CG 3.35Å; G193-E197 PolarHBondContact N-O 2.78Å; P194-E197 WeakPolarHBondContact CD-OE1 3.3Å; Y195-E197 WeakPolarHBondContact CB-OE2 3.32Å; Y195-E197 PolarHBondContact N-OE2 3.32Å
198	G	54.7	Low	56.3	Low	44 Å²	44	79.4 Å²	79.4	45%	0.454	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	139	-179.6	0	0	0	0	0	111.6	I190 G196	I190-G198 CarbonylContact O-C 3.59Å; I190-G198 WeakPolarHBondContact O-CA 3.4Å; G196-G198 PolarHBondContact O-N 2.82Å
199	L	56.3	Low	56	Low	105 Å²	105	82.2 Å²	82.2	55%	0.55	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.5	168.6	-175.7	70.3	0	0	0	108.3	I190 T192	I190-L199 WeakPolarHBondContact CA-O 3.42Å; I190-L199 WeakPolarHBondContact CB-O 3.2Å; I190-L199 PolarHBondContact N-O 3.2Å; I190-L199 PolarHBondContact O-N 2.72Å; T192-L199 HydrophobicContact CG2-CB 3.78Å
200	R	53.2	Low	55.8	Low	116 Å²	116	83.4 Å²	83.4	44%	0.438	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.3	170.6	-78	178.2	-178.7	-108	-4.1	109.4	D88 D187 P202	D88-R200 IonicContact OD2-CZ 2.88Å; D88-R200 IonicContact OD2-NH1 3.08Å; D88-R200 PolarHBondContact OD2-NH1 2.98Å; D88-R200 IonicContact OD2-NH2 2.73Å; D88-R200 PolarHBondContact OD2-NH2 2.92Å; D187-R200 WeakPolarHBondContact OD1-CB 2.96Å; D187-R200 WeakPolarHBondContact OD2-CD 3.49Å; D187-R200 IonicContact OD2-CZ 3.47Å; D187-R200 IonicContact OD2-NH1 3.85Å; D187-R200 PolarHBondContact OD2-NH1 3.17Å; R200-P202 WeakPolarHBondContact O-CD 3.26Å
201	Y	57.4	Low	55.7	Low	129 Å²	129	86 Å²	86	51%	0.506	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	101.4	174.9	-171.9	-93.5	0	0	0	109.5	F188 I190 L203	F188-Y201 PolarHBondContact N-O 2.89Å; F188-Y201 PolarHBondContact O-N 2.79Å; I190-Y201 HydrophobicContact CD1-CD2 4.42Å; I190-Y201 HydrophobicContact CD1-CG 4.19Å; Y201-L203 HydrophobicContact CD1-CB 4.35Å; Y201-L203 HydrophobicContact CE1-CB 4.13Å; Y201-L203 HydrophobicContact CE1-CD1 4.49Å; Y201-L203 PolarHBondContact O-N 2.98Å
202	P	55.1	Low	55.6	Low	78 Å²	78	89.1 Å²	89.1	51%	0.506	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	101.5	174.2	30.8	-32	0	0	0	109.6	L185 R200 S204	L185-P202 HydrophobicContact CD1-CB 3.74Å; R200-P202 WeakPolarHBondContact O-CD 3.26Å; P202-S204 PolarHBondContact O-N 3.17Å
203	L	60.3	Low	55.6	Low	90 Å²	90	86.2 Å²	86.2	47%	0.471	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	106.1	164.4	179.4	63.7	0	0	0	107.8	L186 F188 Y201	L186-L203 PolarHBondContact N-O 2.86Å; L186-L203 PolarHBondContact O-N 3.1Å; F188-L203 HydrophobicContact CE2-CB 4.13Å; F188-L203 HydrophobicContact CE2-CD2 4.44Å; Y201-L203 HydrophobicContact CD1-CB 4.35Å; Y201-L203 HydrophobicContact CE1-CB 4.13Å; Y201-L203 HydrophobicContact CE1-CD1 4.49Å; Y201-L203 PolarHBondContact O-N 2.98Å
204	S	55.1	Low	55.7	Low	82 Å²	82	90.3 Å²	90.3	57%	0.573	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	148.7	173.3	60.4	0	0	0	0	111.8	G184 P202	G184-S204 VanDerWaalsContact O-CA 3.29Å; G184-S204 WeakPolarHBondContact O-CA 3.27Å; P202-S204 PolarHBondContact O-N 3.17Å
205	G	44.3	Very low	55.6	Low	47 Å²	47	90.3 Å²	90.3	49%	0.485	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	127.9	175.6	0	0	0	0	0	110.2	G184	G184-G205 PolarHBondContact N-O 2.91Å; G184-G205 PolarHBondContact O-N 2.79Å
206	T	46.8	Very low	56.1	Low	71 Å²	71	88 Å²	88	44%	0.436	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.7	174.5	54.5	0	0	0	0	109.2	I182 D183	I182-T206 CarbonylContact O-C 3.52Å; I182-T206 WeakPolarHBondContact O-CA 3.21Å; D183-T206 HydrophobicContact CB-CG2 4.09Å; D183-T206 WeakPolarHBondContact OD1-CG2 3.31Å
207	G	51.3	Low	56.5	Low	24 Å²	24	89.3 Å²	89.3	25%	0.247	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.4	170	0	0	0	0	0	110.3	I182	I182-G207 PolarHBondContact N-O 2.82Å; I182-G207 PolarHBondContact O-N 3.07Å
208	Y	53.5	Low	57.2	Low	117 Å²	117	90 Å²	90	46%	0.459	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.2	175.2	-71.2	-95.2	0	0	0	108.9	I181	I181-Y208 HydrophobicContact CB-CE1 4.45Å; I181-Y208 HydrophobicContact CD1-CD1 3.89Å; I181-Y208 HydrophobicContact CD1-CE1 3.32Å; I181-Y208 HydrophobicContact CG1-CD1 3.61Å; I181-Y208 HydrophobicContact CG1-CE1 3.57Å; I181-Y208 HydrophobicContact CG2-CD1 4.4Å; I181-Y208 HydrophobicContact CG2-CE1 4.07Å
209	F	58.2	Low	57.7	Low	124 Å²	124	89.2 Å²	89.2	54%	0.544	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	115.2	178.4	-57.9	-84.6	0	0	0	108.8	Y180 I182	Y180-F209 HydrophobicContact CD1-CD2 4.28Å; Y180-F209 PolarHBondContact N-O 2.76Å; Y180-F209 PolarHBondContact O-N 3.42Å; I182-F209 HydrophobicContact CD1-CE2 4.17Å
210	G	59.7	Low	58.2	Low	51 Å²	51	87.8 Å²	87.8	53%	0.526	46%	0.464	S	S	.	.	S	Bend	trans	159.8	-175.2	178.4	0	0	0	0	0	113.4	N179	N179-G210 VanDerWaalsContact OD1-CA 3.27Å; N179-G210 WeakPolarHBondContact OD1-CA 3.37Å
211	Q	60.8	Low	58.3	Low	138 Å²	138	87.8 Å²	87.8	65%	0.645	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-76.1	131.6	177.2	-170	171.2	-1	0	0	109.3	N179	N179-Q211 PolarHBondContact ND2-O 3.31Å; N179-Q211 PolarHBondContact OD1-N 2.92Å; N179-Q211 PolarHBondContact OD1-O 2.84Å
212	F	60.9	Low	58.1	Low	187 Å²	187	85.6 Å²	85.6	82%	0.82	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-60.2	138.2	172.2	-71	-72.7	0	0	0	109.9
213	P	59.1	Low	57.8	Low	30 Å²	30	86 Å²	86	20%	0.195	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-62	133.5	178	20.9	-24.9	0	0	0	109	A174 Q175 L215	A174-P213 WeakPolarHBondContact O-CA 3.38Å; A174-P213 WeakPolarHBondContact O-CB 3.36Å; Q175-P213 HydrophobicContact CB-CB 4.07Å; Q175-P213 VanDerWaalsContact OE1-CG 3.27Å; P213-L215 PolarHBondContact O-N 2.85Å; P213-L215 VanDerWaalsContact O-N 3.09Å
214	P	61.1	Low	56.9	Low	92 Å²	92	83.5 Å²	83.5	60%	0.597	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-54.8	120.5	165.9	22.5	-34.4	0	0	0	109.7	A174	A174-P214 HydrophobicContact CB-CG 4.35Å; A174-P214 PolarHBondContact N-O 2.82Å; A174-P214 WeakPolarHBondContact O-CD 3.33Å
215	L	57	Low	56.4	Low	79 Å²	79	86.4 Å²	86.4	41%	0.414	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.7	179.4	170.9	64.2	0	0	0	108.4	Q173 P213 I217	Q173-L215 VanDerWaalsContact CD-CD1 3.46Å; Q173-L215 HydrophobicContact CG-CB 4.19Å; Q173-L215 HydrophobicContact CG-CD1 3.51Å; Q173-L215 HydrophobicContact CG-CG 4.46Å; P213-L215 PolarHBondContact O-N 2.85Å; P213-L215 VanDerWaalsContact O-N 3.09Å; L215-I217 HydrophobicContact CD1-CD1 3.77Å; L215-I217 HydrophobicContact CD1-CG1 3.6Å; L215-I217 HydrophobicContact CD2-CD1 3.69Å; L215-I217 HydrophobicContact CD2-CG1 4.29Å; L215-I217 HydrophobicContact CG-CD1 3.86Å; L215-I217 HydrophobicContact CG-CG1 3.88Å
216	F	66.1	Low	56.3	Low	122 Å²	122	87.9 Å²	87.9	54%	0.535	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.5	169.6	175.6	-90.3	0	0	0	109.2	L170 G171 V172	L170-F216 HydrophobicContact CD2-CE1 4.33Å; G171-F216 WeakPolarHBondContact CA-O 3.32Å; V172-F216 HydrophobicContact CG2-CB 3.64Å; V172-F216 HydrophobicContact CG2-CD1 4.02Å; V172-F216 HydrophobicContact CG2-CG 4.29Å; V172-F216 PolarHBondContact N-O 2.84Å; V172-F216 PolarHBondContact O-N 2.84Å
217	I	63.3	Low	56.2	Low	59 Å²	59	88.3 Å²	88.3	30%	0.303	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.1	176.1	-64.8	170.3	0	0	0	107.9	W151 L170 L215	W151-I217 HydrophobicContact CB-CD1 3.89Å; W151-I217 HydrophobicContact CD2-CD1 4.2Å; W151-I217 HydrophobicContact CD2-CG2 3.6Å; W151-I217 HydrophobicContact CE3-CG2 3.59Å; W151-I217 HydrophobicContact CG-CD1 3.81Å; W151-I217 HydrophobicContact CG-CG2 4.3Å; W151-I217 HydrophobicContact CH2-CG2 3.62Å; W151-I217 HydrophobicContact CZ2-CG2 3.63Å; W151-I217 HydrophobicContact CZ3-CG2 3.62Å; L170-I217 WeakPolarHBondContact O-CA 3.25Å; L215-I217 HydrophobicContact CD1-CD1 3.77Å; L215-I217 HydrophobicContact CD1-CG1 3.6Å; L215-I217 HydrophobicContact CD2-CD1 3.69Å; L215-I217 HydrophobicContact CD2-CG1 4.29Å; L215-I217 HydrophobicContact CG-CD1 3.86Å; L215-I217 HydrophobicContact CG-CG1 3.88Å
218	Y	67.6	Low	55.9	Low	104 Å²	104	94.5 Å²	94.5	41%	0.408	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.6	168.4	173.9	-99.4	0	0	0	109.2	L170 Q220	L170-Y218 PolarHBondContact N-O 3.09Å; L170-Y218 PolarHBondContact O-N 3.01Å; Y218-Q220 HydrophobicContact CE1-CB 4.1Å; Y218-Q220 PolarHBondContact OH-OE1 2.87Å
219	G	64.7	Low	55.3	Low	28 Å²	28	93.2 Å²	93.2	29%	0.289	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.8	177.6	0	0	0	0	0	110.7	I168	I168-G219 WeakPolarHBondContact O-CA 3.2Å
220	Q	66.3	Low	54.4	Low	76 Å²	76	96 Å²	96	36%	0.355	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.9	174.5	-166.7	-178.8	-17	0	0	109.8	T167 I168 Y218	T167-Q220 WeakPolarHBondContact CA-O 3.41Å; I168-Q220 PolarHBondContact N-O 2.96Å; I168-Q220 VanDerWaalsContact N-O 3.09Å; I168-Q220 PolarHBondContact O-N 3.03Å; Y218-Q220 HydrophobicContact CE1-CB 4.1Å; Y218-Q220 PolarHBondContact OH-OE1 2.87Å
221	H	55.6	Low	53.5	Low	116 Å²	116	101.1 Å²	101.1	54%	0.537	51%	0.51	S	S	.	.	S	Bend	trans	55.7	56.4	-177.6	-61.7	-64.2	0	0	0	113.2	S166 T167 N223	S166-H221 WeakPolarHBondContact O-CB 3.09Å; T167-H221 WeakPolarHBondContact CG2-O 3.19Å; T167-H221 PolarHBondContact OG1-O 3.02Å; H221-N223 PolarHBondContact O-N 2.6Å
222	L	52.4	Low	52.5	Low	83 Å²	83	98.7 Å²	98.7	44%	0.435	51%	0.513	S	S	.	.			trans	-72.3	105.8	175.9	-66.8	158.6	0	0	0	109.8	W151 P153	W151-L222 HydrophobicContact CH2-CD2 3.89Å; W151-L222 HydrophobicContact CZ2-CD1 4.36Å; W151-L222 HydrophobicContact CZ2-CD2 3.62Å; P153-L222 HydrophobicContact CB-CD2 3.58Å
223	N	49.2	Very low	51.2	Low	85 Å²	85	100.9 Å²	100.9	46%	0.455	52%	0.516	S	S	.	.			trans	78.1	118	175.2	-59.4	-30.1	0	0	0	118.2	P153 H221 I225	P153-N223 PolarHBondContact O-OD1 3Å; H221-N223 PolarHBondContact O-N 2.6Å; N223-I225 PolarHBondContact O-N 2.95Å
224	S	41.2	Very low	50.1	Low	38 Å²	38	108.9 Å²	108.9	27%	0.266	57%	0.568	S	S	.	*			trans	-64.5	108.6	139.5	-177.6	0	0	0	0	106	N162 D226	N162-S224 PolarHBondContact ND2-OG 2.87Å; S224-D226 PolarHBondContact O-N 2.88Å
225	I	44.5	Very low	49.5	Very low	143 Å²	143	109.8 Å²	109.8	73%	0.733	57%	0.567	S	S	*	*			trans	-46.2	131.1	146	-65.7	162.9	0	0	0	105.2	N223 P227	N223-I225 PolarHBondContact O-N 2.95Å; I225-P227 WeakPolarHBondContact O-CD 3.2Å
226	D	43.9	Very low	49.1	Very low	78 Å²	78	111.4 Å²	111.4	42%	0.417	58%	0.575	S	S	.	*			trans	-49.4	111.5	170.2	-171.3	-9.3	0	0	0	106.1	S224 F228 P229	S224-D226 PolarHBondContact O-N 2.88Å; D226-F228 CarbonylContact O-C 3.57Å; D226-F228 PolarHBondContact O-N 2.74Å; D226-F228 PolarHBondContact OD1-N 2.75Å; D226-P229 WeakPolarHBondContact O-CD 3.23Å
227	P	43.7	Very low	48.2	Very low	81 Å²	81	110.8 Å²	110.8	53%	0.526	58%	0.577	S	S	.	*	S	Bend	trans	-65.8	-10.6	-175.2	27.4	-33.9	0	0	0	110.9	I225 P229	I225-P227 WeakPolarHBondContact O-CD 3.2Å; P227-P229 WeakPolarHBondContact O-CD 3.11Å
228	F	45.9	Very low	47.3	Very low	153 Å²	153	113.8 Å²	113.8	67%	0.671	59%	0.593	S	S	*	*			trans	-104.2	75	165.4	-48.5	-71.1	0	0	0	109.4	D226 R230	D226-F228 CarbonylContact O-C 3.57Å; D226-F228 PolarHBondContact O-N 2.74Å; D226-F228 PolarHBondContact OD1-N 2.75Å; F228-R230 PolarHBondContact O-N 2.99Å
229	P	40	Very low	46	Very low	90 Å²	90	114.4 Å²	114.4	58%	0.584	61%	0.605	S	S	*	*			trans	-60.2	103.6	143.1	28.6	-21.4	0	0	0	103.3	D226 P227 L231	D226-P229 WeakPolarHBondContact O-CD 3.23Å; P227-P229 WeakPolarHBondContact O-CD 3.11Å; P229-L231 PolarHBondContact O-N 2.84Å
230	R	40.3	Very low	44.8	Very low	183 Å²	183	120.2 Å²	120.2	69%	0.691	63%	0.626	S	S	*	*			trans	-60.2	99.4	143.5	-78.1	-166	176.8	-176.5	-2	101.8	R135 F228 A232	R135-R230 VanDerWaalsContact NH1-NE 3.14Å; F228-R230 PolarHBondContact O-N 2.99Å; R230-A232 PolarHBondContact O-N 3.34Å
231	L	39.9	Very low	43.3	Very low	159 Å²	159	123.4 Å²	123.4	83%	0.832	65%	0.645	S	S	*	*			trans	-33.8	108.3	144.4	-76.2	160.9	0	0	0	102.8	P229 R233	P229-L231 PolarHBondContact O-N 2.84Å; L231-R233 PolarHBondContact O-N 3.36Å
232	A	40	Very low	42.3	Very low	87 Å²	87	123.9 Å²	123.9	72%	0.719	65%	0.653	S	S	*	*			trans	-45.3	125.8	168.3	0	0	0	0	0	103.6	R230	R230-A232 PolarHBondContact O-N 3.34Å
233	R	34.2	Very low	41.5	Very low	233 Å²	233	127.3 Å²	127.3	88%	0.879	67%	0.672	S	S	*	*			trans	-42.9	132	166.9	-103.4	178.9	-172.6	157.1	0.3	106.1	L231	L231-R233 PolarHBondContact O-N 3.36Å
234	P	35	Very low	40.8	Very low	198 Å²	198	131.2 Å²	131.2	100%	1.286	69%	0.691	S	S	*	*			trans	-52	0	172.9	24.3	-33	0	0	0	110.6

Retrieved 234 of 234 residues in 453.7 ms (Link to these results)

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