A0A5K4EMG8_SCHMA Loading...

Putative ankyrin repeat domain

AlphaFold DB , UniProt , Accession A0A5K4EMG8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,003 aa.

						>A0A5K4EMG8_SCHMA|A0A5K4EMG8
MEDPERHFDWDHAFPDISPISNNTSYGSFRVNQSLDKNLGMYTLPEFNNEDKDEFFIYGTCISVRGEQSESRPEYIDEMVNNSPVLPEYTSTNVEESYKSKINELHKQIRNLEEEASQVPILQDNLRYLYEENVRLHEKDEIKESHRLQNGGHIDSTDEEVEEIVEEEVRTYKKAPKTDPVANDLPSPNHLGNLNNGIDKSQFPSEYWSRLESYFYKRFLLERPFSHNIVMQSSEGNKRTTATMACPIKSSGFRCVGINVCPSIQEVGVLCSRPETREFGCLFYETESMTKEWLNRVFPKMEDKNKKIVHKVIRSFYESREEFVSTLLSIIKKSVCHVGIQSQIVSQSRGCSPILKEIEKVASNPNLINQSPQSQVSEFIQAMPVLNSRCTMTKRHLGVNVGCLTESPVFRSQGTSPKKDLKSFTTCGVQYESNVELVHRGCDPICPELKRIASSTQTQFECSKVVTDAPFHKKDSIVKSNRSTESFEKTEKRQSIQETNDSNSVCITRPSRCDSPRLSQTMIPLSKQPSCTSSYSEGYTVSTERRMVDELSQRYMLLDKVNLDELSSGGQTAFQDVMSKSVDLGSTHVIKEFQPTIEVFHHIGDETEEVDPSTIPDEMLSPFRVNSPPGFPLSPDFTNLKSDPRVRHSSGLSNPPTSDPSAMPPVLIPIIYGQTAKLPEPVLKPLYSKVHSMGTPKPTAVSWIPVRNYRFILSNEAKKACESLIGYYQAEPTVGRAEEMKDKLLTLVKIWFELAATSQIDLLSIEDFIAILHDYSPSLLRDVIQSIDENNSTCLHYSVGHGAWQVVNLILDTGHAHPDHINRSGFSPIMIATLSNITDSSALKTLSRLFSMGDVNLCTNTSARQSPLMLAALHGGVDICSLLIAHGANINAQDASGNTALMYAIEHGHVGVVKCLLGCRDLDLTLVDNNGKNALNVAKSKNDLEILNLIQSAYSVPSKATSSTSEISPSDRYTVERRNTHRLLLDLCDLHHIPVPKSIKFCL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	34.2	Very low	29.1	Very low	246 Å²	246	179.7 Å²	179.7	100%	1.212	85%	0.85	S	S	*	*				0	107.3	0	-75.3	-175	170.7	0	0	105.4
2	E	30.3	Very low	28.9	Very low	183 Å²	183	180.9 Å²	180.9	86%	0.855	85%	0.854	S	S	*	*			trans	-74.5	127.3	178.1	-65.3	167.8	153.9	0	0	107.8
3	D	33.1	Very low	28.7	Very low	165 Å²	165	173.7 Å²	173.7	88%	0.882	84%	0.844	S	S	*	*			trans	-133.4	90.3	163.4	-102.2	-25.7	0	0	0	108.1
4	P	29	Very low	28.3	Very low	114 Å²	114	176 Å²	176	74%	0.74	85%	0.848	S	S	*	*			trans	-107.6	56.5	172.6	38	-26.8	0	0	0	110.9
5	E	30	Very low	28.3	Very low	172 Å²	172	171.9 Å²	171.9	80%	0.804	84%	0.841	S	S	*	*			trans	-144	79.1	172.7	-70.8	-170	179.4	0	0	111.7
6	R	30.5	Very low	28.1	Very low	228 Å²	228	171.3 Å²	171.3	86%	0.86	84%	0.842	S	S	*	*			trans	-129.2	82.2	150	-82.3	-167.3	-177.2	-174.9	1.8	108.8	F8	R6-F8 PolarHBondContact O-N 3.46Å; R6-F8 VanDerWaalsContact O-N 3.14Å
7	H	28.5	Very low	27.9	Very low	175 Å²	175	170.9 Å²	170.9	81%	0.81	84%	0.842	S	S	*	*			trans	-55.9	107.8	156.2	-86.8	-78.6	0	0	0	108.1	D9	H7-D9 PolarHBondContact O-N 3.07Å
8	F	29.4	Very low	27.7	Very low	165 Å²	165	166.5 Å²	166.5	72%	0.724	83%	0.831	S	S	*	*			trans	-82.2	105.3	165.2	-99.1	-93.8	0	0	0	107	R6 W10	R6-F8 PolarHBondContact O-N 3.46Å; R6-F8 VanDerWaalsContact O-N 3.14Å; F8-W10 PolarHBondContact O-N 3.34Å
9	D	26.5	Very low	27.6	Very low	151 Å²	151	164.3 Å²	164.3	81%	0.807	83%	0.83	S	S	*	*			trans	-67	117	173.1	-83.1	-33.7	0	0	0	110.3	H7	H7-D9 PolarHBondContact O-N 3.07Å
10	W	22.7	Very low	27.5	Very low	236 Å²	236	164.2 Å²	164.2	89%	0.894	83%	0.83	S	S	*	*			trans	-91.4	86.6	171.1	-78.8	52.9	0	0	0	108.7	F8	F8-W10 PolarHBondContact O-N 3.34Å
11	D	25.7	Very low	27.3	Very low	142 Å²	142	161.1 Å²	161.1	76%	0.759	82%	0.824	S	S	*	*			trans	-147.9	8.2	174.4	-100.5	-26.4	0	0	0	117.2
12	H	27.2	Very low	26.8	Very low	194 Å²	194	156.8 Å²	156.8	90%	0.898	81%	0.806	S	S	*	*	S	Bend	trans	-134.1	73	-179.4	-71.6	-18.7	0	0	0	113.5
13	A	26.2	Very low	26.4	Very low	87 Å²	87	155.1 Å²	155.1	72%	0.719	80%	0.803	S	S	*	*			trans	-172.5	55.4	153.8	0	0	0	0	0	112.6
14	F	23.5	Very low	26.1	Very low	206 Å²	206	153.9 Å²	153.9	90%	0.904	80%	0.801	S	S	*	*			trans	-112.9	104.9	162.1	-85.5	-80.9	0	0	0	108.7	D16	F14-D16 PolarHBondContact O-N 3.06Å
15	P	27.7	Very low	25.8	Very low	114 Å²	114	153.2 Å²	153.2	74%	0.74	80%	0.799	S	S	*	*			trans	-69.6	124.8	162.7	-6.2	22.6	0	0	0	108	I17	P15-I17 PolarHBondContact O-N 3.28Å
16	D	25.1	Very low	25.5	Very low	162 Å²	162	156.6 Å²	156.6	87%	0.866	81%	0.806	S	S	*	*			trans	-48.9	101	174.6	-78.8	-45.2	0	0	0	112	F14 S18	F14-D16 PolarHBondContact O-N 3.06Å; D16-S18 VanDerWaalsContact C-N 3.29Å; D16-S18 PolarHBondContact O-N 3.31Å; D16-S18 VanDerWaalsContact O-N 3.11Å
17	I	24.6	Very low	25.1	Very low	165 Å²	165	148.6 Å²	148.6	85%	0.846	80%	0.795	S	S	*	*			trans	-81.9	86	164	-57.7	173.9	0	0	0	106.2	P15	P15-I17 PolarHBondContact O-N 3.28Å
18	S	24	Very low	24.8	Very low	92 Å²	92	145.5 Å²	145.5	64%	0.643	79%	0.793	S	S	*	*			trans	-68.6	133.1	164.4	42.6	0	0	0	0	109.1	D16 I20	D16-S18 VanDerWaalsContact C-N 3.29Å; D16-S18 PolarHBondContact O-N 3.31Å; D16-S18 VanDerWaalsContact O-N 3.11Å; S18-I20 PolarHBondContact O-N 3.18Å; S18-I20 VanDerWaalsContact O-N 3.12Å
19	P	26.5	Very low	24.4	Very low	124 Å²	124	147.3 Å²	147.3	81%	0.805	80%	0.801	S	S	*	*			trans	-73.6	107.8	-170.6	26.7	-31.5	0	0	0	110.3	S21	P19-S21 PolarHBondContact O-N 3.37Å; P19-S21 VanDerWaalsContact O-N 3.11Å
20	I	25.3	Very low	24.2	Very low	163 Å²	163	150.9 Å²	150.9	84%	0.836	80%	0.803	S	S	*	*			trans	-66.8	113.2	169.8	-64.2	173.8	0	0	0	107.4	S18	S18-I20 PolarHBondContact O-N 3.18Å; S18-I20 VanDerWaalsContact O-N 3.12Å
21	S	23.9	Very low	24.1	Very low	99 Å²	99	145.8 Å²	145.8	69%	0.692	80%	0.798	S	S	*	*			trans	-54.6	129.2	-179.6	52.4	0	0	0	0	112.9	P19 N23	P19-S21 PolarHBondContact O-N 3.37Å; P19-S21 VanDerWaalsContact O-N 3.11Å; S21-N23 PolarHBondContact O-N 3.23Å
22	N	22.4	Very low	24	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	80%	0.801	S	S	*	*			trans	-52.7	103.5	157.9	-72.7	-32.1	0	0	0	110.3
23	N	23	Very low	23.7	Very low	148 Å²	148	146 Å²	146	79%	0.791	80%	0.799	S	S	*	*			trans	-177.7	104.4	152.9	-98.6	-22.5	0	0	0	109.6	S21	S21-N23 PolarHBondContact O-N 3.23Å
24	T	25.8	Very low	23.6	Very low	138 Å²	138	146.2 Å²	146.2	85%	0.847	80%	0.796	S	S	*	*			trans	-177.1	94.9	135.3	23.4	0	0	0	0	109.8
25	S	23.8	Very low	23.6	Very low	100 Å²	100	143.8 Å²	143.8	70%	0.699	79%	0.792	S	S	*	*			trans	30.1	109.5	135.7	57.7	0	0	0	0	119.1	G27	S25-G27 PolarHBondContact O-N 3.26Å
26	Y	22.3	Very low	23.3	Very low	243 Å²	243	145.6 Å²	145.6	95%	0.953	80%	0.795	S	S	*	*				8	88.3	129.6	-80.8	-93.4	0	0	0	115.8
27	G	23.8	Very low	23.3	Very low	61 Å²	61	146.7 Å²	146.7	63%	0.629	79%	0.792	S	S	*	*			trans	-96.4	91.1	161.9	0	0	0	0	0	109.5	S25 F29	S25-G27 PolarHBondContact O-N 3.26Å; G27-F29 PolarHBondContact O-N 2.98Å
28	S	21	Very low	23.3	Very low	110 Å²	110	146.5 Å²	146.5	77%	0.769	79%	0.793	S	S	*	*			trans	-66.4	91.2	170.3	58.8	0	0	0	0	110	R30	S28-R30 PolarHBondContact O-N 3.07Å
29	F	22	Very low	23.4	Very low	202 Å²	202	150.7 Å²	150.7	89%	0.886	81%	0.807	S	S	*	*			trans	-82.2	102.4	168.3	-89	-85.9	0	0	0	109.3	G27	G27-F29 PolarHBondContact O-N 2.98Å
30	R	21.6	Very low	23.3	Very low	226 Å²	226	147.2 Å²	147.2	85%	0.853	79%	0.794	S	S	*	*			trans	-57.8	138.1	171.3	-82	178.6	172	173.3	-3	110.6	S28 N32	S28-R30 PolarHBondContact O-N 3.07Å; R30-N32 PolarHBondContact O-N 3.15Å; R30-N32 VanDerWaalsContact O-N 3.12Å
31	V	21.7	Very low	23	Very low	129 Å²	129	147.8 Å²	147.8	78%	0.782	80%	0.795	S	S	*	*			trans	-54.8	106.4	167.2	179.1	0	0	0	0	109.3	Q33	V31-Q33 HydrophobicContact CG1-CG 4.37Å; V31-Q33 PolarHBondContact O-N 2.94Å
32	N	22	Very low	23	Very low	154 Å²	154	153.9 Å²	153.9	82%	0.824	81%	0.805	S	S	*	*			trans	-81.2	95.9	164.9	-88	-20	0	0	0	108.1	R30 S34	R30-N32 PolarHBondContact O-N 3.15Å; R30-N32 VanDerWaalsContact O-N 3.12Å; N32-S34 PolarHBondContact O-N 3.12Å
33	Q	22.5	Very low	23	Very low	186 Å²	186	152.6 Å²	152.6	87%	0.869	80%	0.802	S	S	*	*			trans	-67.1	103.5	154.8	-76	176.7	-13	0	0	108	V31	V31-Q33 HydrophobicContact CG1-CG 4.37Å; V31-Q33 PolarHBondContact O-N 2.94Å
34	S	22.7	Very low	23	Very low	93 Å²	93	153.4 Å²	153.4	65%	0.65	81%	0.806	S	S	*	*			trans	-160.9	138.3	152.2	75.3	0	0	0	0	111	N32	N32-S34 PolarHBondContact O-N 3.12Å
35	L	23.5	Very low	22.9	Very low	154 Å²	154	152.5 Å²	152.5	81%	0.806	80%	0.802	S	S	*	*			trans	91.3	71.3	160.7	-64.2	141.2	0	0	0	116.2
36	D	22.3	Very low	22.9	Very low	153 Å²	153	156.9 Å²	156.9	82%	0.818	81%	0.812	S	S	*	*				-49.6	148.9	127.7	-81.4	-42.8	0	0	0	111.3
37	K	25	Very low	22.8	Very low	185 Å²	185	154.4 Å²	154.4	80%	0.804	81%	0.806	S	S	*	*			trans	109.1	113.3	172.8	-62.6	173.3	-178.1	-176.9	0	113.2
38	N	25.4	Very low	23	Very low	160 Å²	160	159.5 Å²	159.5	86%	0.856	82%	0.819	S	S	*	*			trans	131.5	24.8	151.8	-62	-16.2	0	0	0	116.7	G40	N38-G40 PolarHBondContact O-N 2.95Å; N38-G40 VanDerWaalsContact O-N 3.12Å
39	L	24.8	Very low	23.1	Very low	180 Å²	180	160.6 Å²	160.6	94%	0.942	82%	0.816	S	S	*	*			trans	-81.3	85.7	150.7	-94	145.8	0	0	0	108.1	M41	L39-M41 PolarHBondContact O-N 3.42Å
40	G	23.7	Very low	23.4	Very low	51 Å²	51	159.5 Å²	159.5	53%	0.526	81%	0.814	S	S	.	*			trans	-58.5	114	169	0	0	0	0	0	110	N38 Y42	N38-G40 PolarHBondContact O-N 2.95Å; N38-G40 VanDerWaalsContact O-N 3.12Å; G40-Y42 PolarHBondContact O-N 3.38Å
41	M	20.5	Very low	23.7	Very low	175 Å²	175	156.7 Å²	156.7	86%	0.862	82%	0.816	S	S	*	*			trans	-1.2	90.8	139.8	-57	-66.4	-76.5	0	0	114.2	L39 T43	L39-M41 PolarHBondContact O-N 3.42Å; M41-T43 PolarHBondContact O-N 3.25Å
42	Y	24.2	Very low	23.8	Very low	228 Å²	228	159.6 Å²	159.6	89%	0.894	82%	0.818	S	S	*	*			trans	-79.8	105.1	154.4	-82.3	-85.6	0	0	0	107.2	G40 L44	G40-Y42 PolarHBondContact O-N 3.38Å; Y42-L44 PolarHBondContact O-N 3.15Å
43	T	22.3	Very low	24	Very low	128 Å²	128	158.9 Å²	158.9	79%	0.785	81%	0.814	S	S	*	*			trans	-55.4	113.3	173.3	43.6	0	0	0	0	110.5	M41	M41-T43 PolarHBondContact O-N 3.25Å
44	L	22	Very low	24.1	Very low	165 Å²	165	157.8 Å²	157.8	86%	0.864	81%	0.809	S	S	*	*			trans	-69.7	142.3	167.1	-89	153.4	0	0	0	109.7	Y42	Y42-L44 PolarHBondContact O-N 3.15Å
45	P	22.9	Very low	24	Very low	119 Å²	119	162.9 Å²	162.9	77%	0.773	82%	0.82	S	S	*	*			trans	-70.1	137.3	-175.7	-11.2	27.3	0	0	0	112.3
46	E	23.8	Very low	23.9	Very low	192 Å²	192	164 Å²	164	90%	0.897	82%	0.819	S	S	*	*			trans	-9.3	128.1	165	-66	172.4	168.7	0	0	119.3
47	F	22.2	Very low	23.8	Very low	191 Å²	191	163.8 Å²	163.8	84%	0.838	82%	0.816	S	S	*	*			trans	-55.9	141.1	167.3	-76	-105.9	0	0	0	113.4
48	N	26.2	Very low	23.7	Very low	169 Å²	169	164.7 Å²	164.7	90%	0.904	82%	0.816	S	S	*	*			trans	-114.3	122.5	142.5	-96.3	-18.5	0	0	0	108.8
49	N	24.5	Very low	23.4	Very low	132 Å²	132	160.3 Å²	160.3	71%	0.706	81%	0.808	S	S	*	*			trans	-66.6	140.4	177.3	-62.9	-55.4	0	0	0	110.8
50	E	27.3	Very low	23.2	Very low	180 Å²	180	157.4 Å²	157.4	84%	0.841	80%	0.798	S	S	*	*			trans	166	84.3	135.8	-91.5	167	-158.9	0	0	107.1
51	D	28.3	Very low	23	Very low	167 Å²	167	161.3 Å²	161.3	89%	0.893	82%	0.815	S	S	*	*			trans	176.1	105	133.1	-83.3	-22.2	0	0	0	108.7
52	K	24.3	Very low	23.1	Very low	189 Å²	189	160.6 Å²	160.6	82%	0.822	81%	0.813	S	S	*	*			trans	-72.8	141.4	164.7	-62.8	171.5	176.7	175.2	0	106.4
53	D	26.1	Very low	22.9	Very low	140 Å²	140	154.4 Å²	154.4	75%	0.749	80%	0.804	S	S	*	*				178.5	121.6	115.4	-80.8	-20.9	0	0	0	111.5
54	E	23.8	Very low	22.7	Very low	163 Å²	163	154.6 Å²	154.6	76%	0.762	81%	0.805	S	S	*	*			trans	69.9	74.2	139.5	-57.9	-174.5	166.8	0	0	119.5
55	F	20.2	Very low	22.7	Very low	199 Å²	199	158.6 Å²	158.6	87%	0.873	81%	0.808	S	S	*	*			trans	-71.8	110.5	141.2	-86.5	-98	0	0	0	109.7
56	F	23	Very low	22.6	Very low	179 Å²	179	155.8 Å²	155.8	79%	0.785	80%	0.801	S	S	*	*			trans	-131.7	115.2	156	-90.5	-79	0	0	0	111.3
57	I	19.7	Very low	22.6	Very low	148 Å²	148	155.7 Å²	155.7	76%	0.759	80%	0.8	S	S	*	*			trans	-85.4	123.7	172.5	-61.9	164.7	0	0	0	107.2
58	Y	23	Very low	22.5	Very low	204 Å²	204	156 Å²	156	80%	0.8	80%	0.804	S	S	*	*			trans	-139.5	106.6	155.9	-97.5	-80.2	0	0	0	110
59	G	18.8	Very low	22.4	Very low	67 Å²	67	153.7 Å²	153.7	69%	0.691	80%	0.802	S	S	*	*			trans	-69	129.2	158.4	0	0	0	0	0	109.3
60	T	21.6	Very low	22.2	Very low	120 Å²	120	157 Å²	157	74%	0.736	81%	0.813	S	S	*	*			trans	-125.3	116.3	166.6	25	0	0	0	0	108.9
61	C	18.2	Very low	22.2	Very low	132 Å²	132	154.3 Å²	154.3	89%	0.892	81%	0.814	S	S	*	*			trans	-77.9	120.6	175.4	-51	0	0	0	0	107.4
62	I	22.5	Very low	21.9	Very low	160 Å²	160	158 Å²	158	82%	0.821	82%	0.816	S	S	*	*			trans	-118.3	106.4	171.4	-59.2	-179.7	0	0	0	109
63	S	19.5	Very low	21.9	Very low	98 Å²	98	153.2 Å²	153.2	69%	0.685	80%	0.804	S	S	*	*			trans	-75.1	125.5	172	171.6	0	0	0	0	110.6
64	V	19.9	Very low	21.8	Very low	133 Å²	133	154.8 Å²	154.8	81%	0.806	81%	0.807	S	S	*	*			trans	20.1	109.5	138.4	-163.5	0	0	0	0	116.3
65	R	22.2	Very low	21.9	Very low	248 Å²	248	157.2 Å²	157.2	94%	0.936	81%	0.811	S	S	*	*			trans	-128.2	113	151.4	-85.3	-167.2	175.8	-171.9	-0.5	109.2
66	G	20.1	Very low	22.1	Very low	61 Å²	61	152.9 Å²	152.9	63%	0.629	80%	0.796	S	S	*	*			trans	-83.8	-169.7	160.3	0	0	0	0	0	111.3
67	E	23	Very low	22.1	Very low	189 Å²	189	152.4 Å²	152.4	88%	0.883	80%	0.801	S	S	*	*			trans	89.6	95.2	177.1	-54.3	180	175.3	0	0	113
68	Q	20.6	Very low	22.4	Very low	197 Å²	197	153.3 Å²	153.3	92%	0.921	80%	0.802	S	S	*	*				45.7	104.1	81.3	-67.8	-151.2	-10.7	0	0	114
69	S	24.4	Very low	22.5	Very low	122 Å²	122	151.6 Å²	151.6	85%	0.853	80%	0.804	S	S	*	*			trans	-162.2	130.4	136.9	56.5	0	0	0	0	111.2
70	E	20.5	Very low	22.8	Very low	200 Å²	200	154.4 Å²	154.4	94%	0.935	81%	0.807	S	S	*	*			trans	-70.6	135.3	175.8	-61.6	168.6	142.5	0	0	110.1
71	S	26.5	Very low	23	Very low	125 Å²	125	154.8 Å²	154.8	87%	0.874	81%	0.805	S	S	*	*			trans	-139	107.6	159.7	52.5	0	0	0	0	110.4
72	R	21.8	Very low	23.5	Very low	243 Å²	243	156 Å²	156	92%	0.917	80%	0.802	S	S	*	*			trans	-113.7	157.5	156.3	-142.9	-176.4	173.9	179.7	-1.3	103.8
73	P	25.6	Very low	23.5	Very low	89 Å²	89	154 Å²	154	58%	0.578	80%	0.803	S	S	*	*			cis	-147.2	-169.6	17.6	42.9	-21	0	0	0	115.6
74	E	22.4	Very low	23.8	Very low	174 Å²	174	154.9 Å²	154.9	81%	0.813	81%	0.806	S	S	*	*			trans	73.4	101	149.6	-73.4	160.2	-145.4	0	0	120.4
75	Y	26.3	Very low	24.1	Very low	213 Å²	213	155 Å²	155	84%	0.835	81%	0.806	S	S	*	*			trans	-159.9	115.9	131.1	-132.9	-115.4	0	0	0	112.8
76	I	25.5	Very low	24.1	Very low	109 Å²	109	150.5 Å²	150.5	56%	0.559	80%	0.8	S	S	*	*			trans	61.7	107.3	141.3	-55.4	-168.5	0	0	0	120.5	E78	I76-E78 HydrophobicContact CG2-CB 4.41Å; I76-E78 PolarHBondContact O-N 3.33Å
77	D	21.1	Very low	24.3	Very low	168 Å²	168	151.7 Å²	151.7	90%	0.898	80%	0.797	S	S	*	*			trans	-53.3	114.2	146.4	-79.9	-46.9	0	0	0	111.3
78	E	26.5	Very low	24.4	Very low	168 Å²	168	150.8 Å²	150.8	79%	0.785	79%	0.793	S	S	*	*			trans	-143.7	129.2	156.1	-117.5	178.1	-171.6	0	0	110	I76	I76-E78 HydrophobicContact CG2-CB 4.41Å; I76-E78 PolarHBondContact O-N 3.33Å
79	M	25.1	Very low	24.8	Very low	168 Å²	168	151.6 Å²	151.6	83%	0.828	79%	0.789	S	S	*	*			trans	77.9	73.8	161.5	-55.9	-171.9	64.3	0	0	117.9
80	V	25	Very low	24.9	Very low	125 Å²	125	150 Å²	150	76%	0.758	77%	0.774	S	S	*	*			trans	-45.4	133.9	139.2	167.3	0	0	0	0	111
81	N	25.6	Very low	25.5	Very low	129 Å²	129	143.7 Å²	143.7	69%	0.69	75%	0.752	S	S	*	*			trans	74.8	99	165.4	-57.6	-20.8	0	0	0	117.1
82	N	28.6	Very low	26.2	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	73%	0.727	S	S	*	*				-178.6	125.5	117.5	-85.1	-29.3	0	0	0	112.4
83	S	24.3	Very low	27.4	Very low	119 Å²	119	134.9 Å²	134.9	83%	0.832	72%	0.715	S	S	*	*			trans	84.5	145.8	155.4	-62.9	0	0	0	0	118.6
84	P	25.8	Very low	28.2	Very low	116 Å²	116	134.2 Å²	134.2	75%	0.753	71%	0.709	S	S	*	*				-98.9	162.5	-125.3	36.4	-35	0	0	0	113.2	L86	P84-L86 PolarHBondContact O-N 2.94Å
85	V	25.2	Very low	29	Very low	134 Å²	134	129.8 Å²	129.8	81%	0.812	69%	0.689	S	S	*	*			trans	-35.2	106.1	164.8	-179.3	0	0	0	0	110
86	L	22	Very low	30.2	Very low	154 Å²	154	125.6 Å²	125.6	81%	0.806	68%	0.677	S	S	*	*			trans	-54.1	130.1	160.7	-87.2	152.9	0	0	0	106.7	P84 E88	P84-L86 PolarHBondContact O-N 2.94Å; L86-E88 PolarHBondContact O-N 3.08Å
87	P	24.3	Very low	31.7	Very low	86 Å²	86	123.7 Å²	123.7	56%	0.558	67%	0.673	S	S	*	*			trans	-56.3	128.5	177.6	23.5	-30.3	0	0	0	107.4	Y89	P87-Y89 HydrophobicContact CG-CD2 4.19Å; P87-Y89 HydrophobicContact CG-CE2 3.96Å; P87-Y89 PolarHBondContact O-N 3.04Å
88	E	25.2	Very low	32.9	Very low	171 Å²	171	118.8 Å²	118.8	80%	0.799	64%	0.643	S	S	*	*			trans	-53.6	96.5	162.4	-70.1	178	169.7	0	0	106	L86 T90	L86-E88 PolarHBondContact O-N 3.08Å; E88-T90 HydrophobicContact CB-CG2 4.38Å; E88-T90 PolarHBondContact O-N 3.08Å
89	Y	28	Very low	34.6	Very low	214 Å²	214	116.4 Å²	116.4	84%	0.839	63%	0.629	S	S	*	*			trans	-68.5	87.1	162	-91.5	-85.3	0	0	0	104.9	P87 S91	P87-Y89 HydrophobicContact CG-CD2 4.19Å; P87-Y89 HydrophobicContact CG-CE2 3.96Å; P87-Y89 PolarHBondContact O-N 3.04Å; Y89-S91 PolarHBondContact O-N 3.01Å
90	T	27.9	Very low	36.7	Very low	89 Å²	89	112 Å²	112	55%	0.546	62%	0.615	S	S	.	*			trans	-62	84.3	162.7	53.5	0	0	0	0	106.9	E88 T92	E88-T90 HydrophobicContact CB-CG2 4.38Å; E88-T90 PolarHBondContact O-N 3.08Å; T90-T92 WeakPolarHBondContact CB-OG1 3.01Å; T90-T92 HydrophobicContact CG2-CG2 4.12Å; T90-T92 PolarHBondContact O-N 3.43Å
91	S	33.5	Very low	38.8	Very low	66 Å²	66	112.5 Å²	112.5	46%	0.462	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	36.2	153.1	-172.6	0	0	0	0	109.9	Y89	Y89-S91 PolarHBondContact O-N 3.01Å
92	T	40.2	Very low	40.3	Very low	58 Å²	58	107.2 Å²	107.2	36%	0.356	58%	0.579	S	S	.	*	H	α-helix	trans	-80.6	-23	-179.4	55.3	0	0	0	0	111	T90 V94 E95 E96	T90-T92 WeakPolarHBondContact CB-OG1 3.01Å; T90-T92 HydrophobicContact CG2-CG2 4.12Å; T90-T92 PolarHBondContact O-N 3.43Å; T92-V94 VanDerWaalsContact C-N 3.28Å; T92-V94 PolarHBondContact O-N 2.93Å; T92-E95 PolarHBondContact O-N 3.22Å; T92-E96 VanDerWaalsContact O-CB 3.27Å; T92-E96 WeakPolarHBondContact O-CB 3.49Å; T92-E96 WeakPolarHBondContact O-CG 3.41Å; T92-E96 PolarHBondContact O-N 3.46Å
93	N	47	Very low	42.4	Very low	125 Å²	125	104.6 Å²	104.6	67%	0.668	57%	0.565	S	S	*	*	H	α-helix	trans	-66.2	-31.2	-179.7	-83.1	-12.9	0	0	0	113	S97	N93-S97 WeakPolarHBondContact O-CB 3.37Å; N93-S97 PolarHBondContact O-N 3.42Å; N93-S97 VanDerWaalsContact O-N 3.08Å
94	V	41.7	Very low	44.9	Very low	76 Å²	76	103.4 Å²	103.4	46%	0.461	55%	0.546	S	S	.	.	H	α-helix	trans	-80.7	-45	178.8	-178.4	0	0	0	0	110	T92 E96 S97 Y98	T92-V94 VanDerWaalsContact C-N 3.28Å; T92-V94 PolarHBondContact O-N 2.93Å; V94-E96 VanDerWaalsContact C-N 3.33Å; V94-E96 PolarHBondContact O-N 2.96Å; V94-S97 PolarHBondContact O-N 3.31Å; V94-Y98 HydrophobicContact CG1-CD2 3.52Å; V94-Y98 HydrophobicContact CG1-CE2 3.26Å; V94-Y98 WeakPolarHBondContact O-CD2 3.27Å; V94-Y98 PolarHBondContact O-N 3.16Å
95	E	40.3	Very low	46.5	Very low	80 Å²	80	98.9 Å²	98.9	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-58.6	-41.7	172.8	-82	-171.1	-156.9	0	0	112.7	T92 K99 R147	T92-E95 PolarHBondContact O-N 3.22Å; E95-K99 WeakPolarHBondContact O-CB 3.39Å; E95-K99 VanDerWaalsContact O-CG 3.28Å; E95-K99 WeakPolarHBondContact O-CG 3.47Å; E95-K99 PolarHBondContact O-N 3.4Å; E95-K99 IonicContact OE2-NZ 2.66Å; E95-K99 PolarHBondContact OE2-NZ 3.07Å; E95-R147 IonicContact OE1-NH1 3.8Å
96	E	52	Low	48.8	Very low	125 Å²	125	95.3 Å²	95.3	58%	0.584	49%	0.49	S	S	*	.	H	α-helix	trans	-69.2	-37.4	176.8	-76.8	-174.8	177.3	0	0	111.8	T92 V94 S100	T92-E96 VanDerWaalsContact O-CB 3.27Å; T92-E96 WeakPolarHBondContact O-CB 3.49Å; T92-E96 WeakPolarHBondContact O-CG 3.41Å; T92-E96 PolarHBondContact O-N 3.46Å; V94-E96 VanDerWaalsContact C-N 3.33Å; V94-E96 PolarHBondContact O-N 2.96Å; E96-S100 WeakPolarHBondContact O-CA 3.41Å; E96-S100 WeakPolarHBondContact O-CB 3.39Å; E96-S100 PolarHBondContact O-N 3.41Å
97	S	57.5	Low	51.3	Low	70 Å²	70	93.7 Å²	93.7	49%	0.49	48%	0.476	S	S	.	.	H	α-helix	trans	-63.4	-44.6	174.7	-176.6	0	0	0	0	111.4	N93 V94 S100 K101	N93-S97 WeakPolarHBondContact O-CB 3.37Å; N93-S97 PolarHBondContact O-N 3.42Å; N93-S97 VanDerWaalsContact O-N 3.08Å; V94-S97 PolarHBondContact O-N 3.31Å; S97-S100 WeakPolarHBondContact O-CB 3.41Å; S97-S100 PolarHBondContact O-N 3.27Å; S97-K101 WeakPolarHBondContact O-CB 3.27Å; S97-K101 PolarHBondContact O-N 3.39Å
98	Y	46.2	Very low	53.5	Low	65 Å²	65	93.8 Å²	93.8	26%	0.255	47%	0.469	S	S	.	.	H	α-helix	trans	-70.9	-44.5	176.8	-74.7	-68.9	0	0	0	112.3	V94 S100 K101 I102	V94-Y98 HydrophobicContact CG1-CD2 3.52Å; V94-Y98 HydrophobicContact CG1-CE2 3.26Å; V94-Y98 WeakPolarHBondContact O-CD2 3.27Å; V94-Y98 PolarHBondContact O-N 3.16Å; Y98-S100 VanDerWaalsContact C-N 3.26Å; Y98-S100 PolarHBondContact O-N 3.25Å; Y98-K101 CarbonylContact O-C 3.43Å; Y98-K101 PolarHBondContact O-N 3Å; Y98-I102 WeakPolarHBondContact O-CB 3.11Å; Y98-I102 VanDerWaalsContact O-CG1 3.32Å; Y98-I102 WeakPolarHBondContact O-CG1 3.1Å; Y98-I102 PolarHBondContact O-N 3.44Å
99	K	61.8	Low	55	Low	117 Å²	117	85.9 Å²	85.9	51%	0.509	43%	0.432	S	S	.	.	H	α-helix	trans	-58.1	-39.6	172.4	-79	169.3	178.1	154.9	0	111.4	E95 N103	E95-K99 WeakPolarHBondContact O-CB 3.39Å; E95-K99 VanDerWaalsContact O-CG 3.28Å; E95-K99 WeakPolarHBondContact O-CG 3.47Å; E95-K99 PolarHBondContact O-N 3.4Å; E95-K99 IonicContact OE2-NZ 2.66Å; E95-K99 PolarHBondContact OE2-NZ 3.07Å; K99-N103 VanDerWaalsContact O-CB 3.25Å; K99-N103 WeakPolarHBondContact O-CB 3.37Å; K99-N103 PolarHBondContact O-N 3.29Å; K99-N103 PolarHBondContact O-ND2 2.91Å; K99-N103 VanDerWaalsContact O-ND2 3.08Å
100	S	67.9	Low	56.8	Low	75 Å²	75	82.6 Å²	82.6	52%	0.524	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-45.7	172.8	168.7	0	0	0	0	111.3	E96 S97 Y98 N103 E104	E96-S100 WeakPolarHBondContact O-CA 3.41Å; E96-S100 WeakPolarHBondContact O-CB 3.39Å; E96-S100 PolarHBondContact O-N 3.41Å; S97-S100 WeakPolarHBondContact O-CB 3.41Å; S97-S100 PolarHBondContact O-N 3.27Å; Y98-S100 VanDerWaalsContact C-N 3.26Å; Y98-S100 PolarHBondContact O-N 3.25Å; S100-N103 PolarHBondContact O-N 2.67Å; S100-E104 WeakPolarHBondContact O-CB 3.2Å; S100-E104 PolarHBondContact O-N 3.27Å
101	K	69	Low	58.8	Low	136 Å²	136	82.9 Å²	82.9	59%	0.591	42%	0.417	S	S	*	.	H	α-helix	trans	-64.9	-43.5	179.4	-138.3	155.8	-174.3	177	0	111.7	S97 Y98 E104 L105	S97-K101 WeakPolarHBondContact O-CB 3.27Å; S97-K101 PolarHBondContact O-N 3.39Å; Y98-K101 CarbonylContact O-C 3.43Å; Y98-K101 PolarHBondContact O-N 3Å; K101-E104 PolarHBondContact O-N 3.43Å; K101-L105 WeakPolarHBondContact O-CB 3.32Å; K101-L105 PolarHBondContact O-N 3.22Å
102	I	58.3	Low	59.4	Low	19 Å²	19	81.1 Å²	81.1	10%	0.097	40%	0.402	C	S	.	.	H	α-helix	trans	-60.5	-44.6	173.1	-69.8	168.3	0	0	0	110.5	Y98 E104 L105 H106 D140	Y98-I102 WeakPolarHBondContact O-CB 3.11Å; Y98-I102 VanDerWaalsContact O-CG1 3.32Å; Y98-I102 WeakPolarHBondContact O-CG1 3.1Å; Y98-I102 PolarHBondContact O-N 3.44Å; I102-E104 PolarHBondContact O-N 3.3Å; I102-L105 PolarHBondContact O-N 3.32Å; I102-H106 WeakPolarHBondContact CG2-CE1 3.46Å; I102-H106 WeakPolarHBondContact CG2-ND1 3.37Å; I102-H106 WeakPolarHBondContact O-CB 3.44Å; I102-H106 PolarHBondContact O-N 3.47Å; I102-H106 PolarHBondContact O-ND1 3.44Å; I102-H106 VanDerWaalsContact O-ND1 3.09Å; I102-D140 WeakPolarHBondContact CD1-OD2 3.39Å
103	N	72.4	Confident	60.2	Low	102 Å²	102	82.2 Å²	82.2	55%	0.545	40%	0.403	S	S	.	.	H	α-helix	trans	-64.5	-40	177.5	-77	-29.7	0	0	0	112.7	K99 S100 K107	K99-N103 VanDerWaalsContact O-CB 3.25Å; K99-N103 WeakPolarHBondContact O-CB 3.37Å; K99-N103 PolarHBondContact O-N 3.29Å; K99-N103 PolarHBondContact O-ND2 2.91Å; K99-N103 VanDerWaalsContact O-ND2 3.08Å; S100-N103 PolarHBondContact O-N 2.67Å; N103-K107 WeakPolarHBondContact O-CB 3.28Å; N103-K107 PolarHBondContact O-N 3.1Å
104	E	76.1	Confident	60.7	Low	94 Å²	94	82.8 Å²	82.8	44%	0.439	40%	0.402	S	S	.	.	H	α-helix	trans	-67.5	-41.7	175.8	-171.2	60	-159	0	0	111	S100 K101 I102 K107 Q108	S100-E104 WeakPolarHBondContact O-CB 3.2Å; S100-E104 PolarHBondContact O-N 3.27Å; K101-E104 PolarHBondContact O-N 3.43Å; I102-E104 PolarHBondContact O-N 3.3Å; E104-K107 CarbonylContact O-C 3.49Å; E104-K107 WeakPolarHBondContact O-CA 3.44Å; E104-K107 WeakPolarHBondContact O-CB 3.12Å; E104-K107 PolarHBondContact O-N 3.43Å; E104-Q108 WeakPolarHBondContact O-CG 3.36Å; E104-Q108 PolarHBondContact O-N 3.24Å
105	L	59.8	Low	60.9	Low	20 Å²	20	84.2 Å²	84.2	11%	0.105	40%	0.403	C	S	.	.	H	α-helix	trans	-62.5	-44.5	174.7	-126.8	149	0	0	0	111.5	K101 I102 K107 Q108 I109 L129 N133 L136	K101-L105 WeakPolarHBondContact O-CB 3.32Å; K101-L105 PolarHBondContact O-N 3.22Å; I102-L105 PolarHBondContact O-N 3.32Å; L105-K107 PolarHBondContact O-N 2.93Å; L105-Q108 PolarHBondContact O-N 3.47Å; L105-Q108 VanDerWaalsContact O-N 3.16Å; L105-I109 HydrophobicContact CD2-CD1 3.89Å; L105-I109 HydrophobicContact CD2-CG1 4.28Å; L105-I109 WeakPolarHBondContact O-CB 3.27Å; L105-I109 VanDerWaalsContact O-CG1 3.32Å; L105-I109 WeakPolarHBondContact O-CG1 3.26Å; L105-I109 PolarHBondContact O-N 3.45Å; L105-L129 HydrophobicContact CD2-CB 4.4Å; L105-L129 HydrophobicContact CD2-CD2 3.76Å; L105-N133 HydrophobicContact CD2-CB 4.49Å; L105-L136 HydrophobicContact CD1-CD1 3.67Å
106	H	75	Confident	61.1	Low	59 Å²	59	81.1 Å²	81.1	27%	0.273	39%	0.392	S	S	.	.	H	α-helix	trans	-61.9	-29.7	172.1	-74.9	135.4	0	0	0	112.9	I102 R110 N133	I102-H106 WeakPolarHBondContact CG2-CE1 3.46Å; I102-H106 WeakPolarHBondContact CG2-ND1 3.37Å; I102-H106 WeakPolarHBondContact O-CB 3.44Å; I102-H106 PolarHBondContact O-N 3.47Å; I102-H106 PolarHBondContact O-ND1 3.44Å; I102-H106 VanDerWaalsContact O-ND1 3.09Å; H106-R110 WeakPolarHBondContact O-CB 3.36Å; H106-R110 WeakPolarHBondContact O-CG 3.37Å; H106-R110 PolarHBondContact O-N 3.43Å; H106-R110 VanDerWaalsContact O-N 3.11Å; H106-R110 PolarHBondContact O-NE 2.96Å; H106-R110 VanDerWaalsContact O-NE 3.11Å; H106-N133 PolarHBondContact CD2-ND2 3.33Å; H106-N133 PolarHBondContact NE2-ND2 3.38Å
107	K	74.4	Confident	60.9	Low	121 Å²	121	79.9 Å²	79.9	53%	0.526	40%	0.397	S	S	.	.	H	α-helix	trans	-71.7	-43.1	174	-138.6	177.6	-176.9	-179.3	0	111.1	N103 E104 L105 R110 N111	N103-K107 WeakPolarHBondContact O-CB 3.28Å; N103-K107 PolarHBondContact O-N 3.1Å; E104-K107 CarbonylContact O-C 3.49Å; E104-K107 WeakPolarHBondContact O-CA 3.44Å; E104-K107 WeakPolarHBondContact O-CB 3.12Å; E104-K107 PolarHBondContact O-N 3.43Å; L105-K107 PolarHBondContact O-N 2.93Å; K107-R110 PolarHBondContact O-N 3.08Å; K107-N111 PolarHBondContact O-N 3.01Å
108	Q	69.6	Low	60.5	Low	87 Å²	87	82.5 Å²	82.5	41%	0.407	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-43.1	175.9	-70.4	176.9	2.6	0	0	111.7	E104 L105 N111 L112	E104-Q108 WeakPolarHBondContact O-CG 3.36Å; E104-Q108 PolarHBondContact O-N 3.24Å; L105-Q108 PolarHBondContact O-N 3.47Å; L105-Q108 VanDerWaalsContact O-N 3.16Å; Q108-N111 PolarHBondContact O-N 2.69Å; Q108-L112 VanDerWaalsContact O-CB 3.31Å; Q108-L112 WeakPolarHBondContact O-CB 3.46Å; Q108-L112 WeakPolarHBondContact O-CG 3.44Å; Q108-L112 PolarHBondContact O-N 3.19Å
109	I	56.2	Low	60.2	Low	6 Å²	6	82.4 Å²	82.4	3%	0.031	41%	0.407	C	S	.	.	H	α-helix	trans	-59.8	-47.8	174.4	-70.4	168.1	0	0	0	109.9	L105 N111 L112 E113 L126 L129 Y130 N133	L105-I109 HydrophobicContact CD2-CD1 3.89Å; L105-I109 HydrophobicContact CD2-CG1 4.28Å; L105-I109 WeakPolarHBondContact O-CB 3.27Å; L105-I109 VanDerWaalsContact O-CG1 3.32Å; L105-I109 WeakPolarHBondContact O-CG1 3.26Å; L105-I109 PolarHBondContact O-N 3.45Å; I109-N111 PolarHBondContact O-N 3.04Å; I109-L112 CarbonylContact O-C 3.56Å; I109-L112 PolarHBondContact O-N 3.21Å; I109-L112 VanDerWaalsContact O-N 3.16Å; I109-E113 HydrophobicContact CG2-CG 4.11Å; I109-E113 WeakPolarHBondContact CG2-OE1 3.29Å; I109-E113 WeakPolarHBondContact O-CB 3.22Å; I109-E113 VanDerWaalsContact O-CG 3.29Å; I109-E113 WeakPolarHBondContact O-CG 3.29Å; I109-E113 PolarHBondContact O-N 3.42Å; I109-L126 HydrophobicContact CG2-CD2 4.19Å; I109-L129 HydrophobicContact CD1-CB 4.33Å; I109-L129 HydrophobicContact CG1-CB 3.88Å; I109-L129 HydrophobicContact CG1-CD1 4.35Å; I109-Y130 HydrophobicContact CG2-CE1 4.07Å; I109-N133 HydrophobicContact CD1-CB 4.12Å
110	R	67.1	Low	59.5	Low	144 Å²	144	81.6 Å²	81.6	54%	0.543	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-43.4	177.1	-79.3	179.9	-67.5	-149.5	-1.4	113.2	H106 K107 L112 E113 E114	H106-R110 WeakPolarHBondContact O-CB 3.36Å; H106-R110 WeakPolarHBondContact O-CG 3.37Å; H106-R110 PolarHBondContact O-N 3.43Å; H106-R110 VanDerWaalsContact O-N 3.11Å; H106-R110 PolarHBondContact O-NE 2.96Å; H106-R110 VanDerWaalsContact O-NE 3.11Å; K107-R110 PolarHBondContact O-N 3.08Å; R110-L112 VanDerWaalsContact C-N 3.3Å; R110-L112 PolarHBondContact O-N 3.33Å; R110-E113 PolarHBondContact O-N 3.01Å; R110-E114 PolarHBondContact O-N 3.04Å
111	N	68.2	Low	58.4	Low	95 Å²	95	84.5 Å²	84.5	51%	0.508	42%	0.422	S	S	.	.	H	α-helix	trans	-60.8	-42	174.2	-89	4.1	0	0	0	111.1	K107 Q108 I109 E114 E115	K107-N111 PolarHBondContact O-N 3.01Å; Q108-N111 PolarHBondContact O-N 2.69Å; I109-N111 PolarHBondContact O-N 3.04Å; N111-E114 WeakPolarHBondContact O-CB 3.31Å; N111-E114 PolarHBondContact O-N 3.37Å; N111-E115 WeakPolarHBondContact O-CG 3.06Å; N111-E115 PolarHBondContact O-N 3.09Å
112	L	46.9	Very low	57.2	Low	29 Å²	29	79.4 Å²	79.4	15%	0.152	40%	0.401	C	S	.	.	H	α-helix	trans	-76.9	-26.6	-179.9	-77.4	165.6	0	0	0	113.2	Q108 I109 R110 E115 A116 L122 L126 L129	Q108-L112 VanDerWaalsContact O-CB 3.31Å; Q108-L112 WeakPolarHBondContact O-CB 3.46Å; Q108-L112 WeakPolarHBondContact O-CG 3.44Å; Q108-L112 PolarHBondContact O-N 3.19Å; I109-L112 CarbonylContact O-C 3.56Å; I109-L112 PolarHBondContact O-N 3.21Å; I109-L112 VanDerWaalsContact O-N 3.16Å; R110-L112 VanDerWaalsContact C-N 3.3Å; R110-L112 PolarHBondContact O-N 3.33Å; L112-E115 PolarHBondContact O-N 3.3Å; L112-A116 WeakPolarHBondContact O-CA 3.44Å; L112-A116 WeakPolarHBondContact O-CB 3.46Å; L112-A116 PolarHBondContact O-N 3.09Å; L112-L122 HydrophobicContact CD2-CD1 4.36Å; L112-L122 HydrophobicContact CD2-CD2 3.93Å; L112-L126 HydrophobicContact CB-CD2 3.99Å; L112-L126 HydrophobicContact CB-CG 4.16Å; L112-L129 HydrophobicContact CD1-CD1 3.17Å
113	E	57.9	Low	56.6	Low	81 Å²	81	84.7 Å²	84.7	38%	0.379	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-43.2	167.8	-76.6	171.7	174.9	0	0	109.8	I109 R110 S117 L126 Y130	I109-E113 HydrophobicContact CG2-CG 4.11Å; I109-E113 WeakPolarHBondContact CG2-OE1 3.29Å; I109-E113 WeakPolarHBondContact O-CB 3.22Å; I109-E113 VanDerWaalsContact O-CG 3.29Å; I109-E113 WeakPolarHBondContact O-CG 3.29Å; I109-E113 PolarHBondContact O-N 3.42Å; R110-E113 PolarHBondContact O-N 3.01Å; E113-S117 PolarHBondContact O-N 3.29Å; E113-S117 VanDerWaalsContact O-N 3.09Å; E113-L126 HydrophobicContact CG-CD1 4.34Å; E113-L126 HydrophobicContact CG-CD2 3.8Å; E113-Y130 PolarHBondContact OE1-OH 2.94Å
114	E	55.8	Low	55.4	Low	138 Å²	138	85.4 Å²	85.4	65%	0.645	43%	0.429	S	S	*	.	H	α-helix	trans	-62.5	-40.5	172.5	-77.2	-171.9	165.7	0	0	112	R110 N111 S117	R110-E114 PolarHBondContact O-N 3.04Å; N111-E114 WeakPolarHBondContact O-CB 3.31Å; N111-E114 PolarHBondContact O-N 3.37Å; E114-S117 PolarHBondContact O-OG 3.38Å
115	E	46.1	Very low	54	Low	105 Å²	105	85 Å²	85	49%	0.491	43%	0.43	S	S	.	.	H	α-helix	trans	-77.9	-38	178.8	-70.6	-179.1	175.2	0	0	113.3	N111 L112 S117 Q118 V119 L122	N111-E115 WeakPolarHBondContact O-CG 3.06Å; N111-E115 PolarHBondContact O-N 3.09Å; L112-E115 PolarHBondContact O-N 3.3Å; E115-S117 VanDerWaalsContact C-N 3.29Å; E115-S117 PolarHBondContact O-N 3Å; E115-Q118 CarbonylContact O-C 3.49Å; E115-Q118 WeakPolarHBondContact O-CA 3.14Å; E115-Q118 WeakPolarHBondContact O-CB 3.12Å; E115-Q118 PolarHBondContact O-N 3.43Å; E115-V119 PolarHBondContact O-N 3.2Å; E115-V119 VanDerWaalsContact O-N 3.13Å; E115-L122 HydrophobicContact CB-CD1 3.42Å; E115-L122 VanDerWaalsContact CB-CD1 3.42Å
116	A	44.1	Very low	53.3	Low	16 Å²	16	85 Å²	85	13%	0.132	43%	0.43	C	S	.	.	H	α-helix	trans	-72.4	-24.3	-179.8	0	0	0	0	0	112.4	L112 Q118 V119 L122 L126	L112-A116 WeakPolarHBondContact O-CA 3.44Å; L112-A116 WeakPolarHBondContact O-CB 3.46Å; L112-A116 PolarHBondContact O-N 3.09Å; A116-Q118 PolarHBondContact O-N 2.96Å; A116-Q118 VanDerWaalsContact O-N 3.1Å; A116-V119 PolarHBondContact O-N 2.88Å; A116-L122 HydrophobicContact CB-CB 3.63Å; A116-L126 HydrophobicContact CB-CD1 3.26Å; A116-L126 HydrophobicContact CB-CG 4.25Å
117	S	48.5	Very low	52.3	Low	98 Å²	98	89.4 Å²	89.4	69%	0.685	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-19.3	164.3	79.6	0	0	0	0	112.5	E113 E114 E115	E113-S117 PolarHBondContact O-N 3.29Å; E113-S117 VanDerWaalsContact O-N 3.09Å; E114-S117 PolarHBondContact O-OG 3.38Å; E115-S117 VanDerWaalsContact C-N 3.29Å; E115-S117 PolarHBondContact O-N 3Å
118	Q	48.3	Very low	51.5	Low	125 Å²	125	90.7 Å²	90.7	58%	0.584	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-16.2	179.7	-55	-171.9	37.6	0	0	114.1	E115 A116	E115-Q118 CarbonylContact O-C 3.49Å; E115-Q118 WeakPolarHBondContact O-CA 3.14Å; E115-Q118 WeakPolarHBondContact O-CB 3.12Å; E115-Q118 PolarHBondContact O-N 3.43Å; A116-Q118 PolarHBondContact O-N 2.96Å; A116-Q118 VanDerWaalsContact O-N 3.1Å
119	V	41.8	Very low	50.4	Low	64 Å²	64	87.6 Å²	87.6	39%	0.388	43%	0.433	S	S	.	.			trans	-143.9	109.5	-174.4	-172.5	0	0	0	0	110.6	E115 A116 I121 L122	E115-V119 PolarHBondContact O-N 3.2Å; E115-V119 VanDerWaalsContact O-N 3.13Å; A116-V119 PolarHBondContact O-N 2.88Å; V119-I121 HydrophobicContact CG1-CB 4.02Å; V119-I121 PolarHBondContact O-N 3.42Å; V119-I121 VanDerWaalsContact O-N 3.12Å; V119-L122 HydrophobicContact CB-CD1 4Å; V119-L122 HydrophobicContact CB-CG 4.16Å; V119-L122 HydrophobicContact CG1-CG 4.43Å; V119-L122 HydrophobicContact CG2-CD1 4.47Å; V119-L122 WeakPolarHBondContact O-CB 3.46Å; V119-L122 PolarHBondContact O-N 3.27Å
120	P	45.7	Very low	50.5	Low	99 Å²	99	92.4 Å²	92.4	64%	0.643	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.3	179.7	-24.4	32.7	0	0	0	114	L122 Q123	P120-L122 PolarHBondContact O-N 3Å; P120-Q123 VanDerWaalsContact O-CB 3.28Å; P120-Q123 WeakPolarHBondContact O-CB 3.38Å; P120-Q123 WeakPolarHBondContact O-CG 3.46Å; P120-Q123 PolarHBondContact O-N 3.25Å
121	I	46.1	Very low	50.4	Low	137 Å²	137	89.6 Å²	89.6	70%	0.703	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-20	178.6	-66.7	162.7	0	0	0	112	V119 Q123	V119-I121 HydrophobicContact CG1-CB 4.02Å; V119-I121 PolarHBondContact O-N 3.42Å; V119-I121 VanDerWaalsContact O-N 3.12Å; I121-Q123 VanDerWaalsContact C-N 3.29Å; I121-Q123 PolarHBondContact O-N 2.97Å
122	L	42.2	Very low	50.1	Low	28 Å²	28	87.9 Å²	87.9	15%	0.147	43%	0.434	C	S	.	.	H	α-helix	trans	-80.8	-5.9	174.1	-66.3	173.3	0	0	0	113.4	L112 E115 A116 V119 P120 D124 N125 L126	L112-L122 HydrophobicContact CD2-CD1 4.36Å; L112-L122 HydrophobicContact CD2-CD2 3.93Å; E115-L122 HydrophobicContact CB-CD1 3.42Å; E115-L122 VanDerWaalsContact CB-CD1 3.42Å; A116-L122 HydrophobicContact CB-CB 3.63Å; V119-L122 HydrophobicContact CB-CD1 4Å; V119-L122 HydrophobicContact CB-CG 4.16Å; V119-L122 HydrophobicContact CG1-CG 4.43Å; V119-L122 HydrophobicContact CG2-CD1 4.47Å; V119-L122 WeakPolarHBondContact O-CB 3.46Å; V119-L122 PolarHBondContact O-N 3.27Å; P120-L122 PolarHBondContact O-N 3Å; L122-D124 VanDerWaalsContact C-N 3.28Å; L122-D124 PolarHBondContact O-N 3.28Å; L122-N125 PolarHBondContact O-N 3.41Å; L122-L126 WeakPolarHBondContact O-CB 3.49Å; L122-L126 PolarHBondContact O-N 2.9Å
123	Q	46.7	Very low	50.4	Low	131 Å²	131	87.3 Å²	87.3	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-62.6	-35.2	174.1	-77	-175.5	-30.9	0	0	112.1	P120 I121 L126 R127	P120-Q123 VanDerWaalsContact O-CB 3.28Å; P120-Q123 WeakPolarHBondContact O-CB 3.38Å; P120-Q123 WeakPolarHBondContact O-CG 3.46Å; P120-Q123 PolarHBondContact O-N 3.25Å; I121-Q123 VanDerWaalsContact C-N 3.29Å; I121-Q123 PolarHBondContact O-N 2.97Å; Q123-L126 PolarHBondContact O-N 3.19Å; Q123-R127 WeakPolarHBondContact O-CB 3.41Å; Q123-R127 PolarHBondContact O-N 3.33Å
124	D	47.1	Very low	50.6	Low	117 Å²	117	87.2 Å²	87.2	63%	0.626	44%	0.435	S	S	*	.	H	α-helix	trans	-70.5	-39.2	177.9	-73.3	-23.5	0	0	0	111.6	L122 R127 Y128	L122-D124 VanDerWaalsContact C-N 3.28Å; L122-D124 PolarHBondContact O-N 3.28Å; D124-R127 PolarHBondContact O-N 3.21Å; D124-Y128 WeakPolarHBondContact O-CB 3.33Å; D124-Y128 PolarHBondContact O-N 3.49Å
125	N	46.1	Very low	50.9	Low	86 Å²	86	85.5 Å²	85.5	46%	0.46	42%	0.423	S	S	.	.	H	α-helix	trans	-65.1	-42.7	173.8	-72.2	-12.9	0	0	0	111.5	L122 R127 Y128 L129	L122-N125 PolarHBondContact O-N 3.41Å; N125-R127 VanDerWaalsContact C-N 3.34Å; N125-Y128 PolarHBondContact O-N 2.93Å; N125-L129 WeakPolarHBondContact O-CG 3.45Å; N125-L129 PolarHBondContact O-N 3.1Å
126	L	44.7	Very low	51.6	Low	18 Å²	18	82 Å²	82	9%	0.094	41%	0.407	C	S	.	.	H	α-helix	trans	-61.5	-44.9	173.3	-91.7	172.7	0	0	0	111.4	I109 L112 E113 A116 L122 Q123 Y128 L129 Y130	I109-L126 HydrophobicContact CG2-CD2 4.19Å; L112-L126 HydrophobicContact CB-CD2 3.99Å; L112-L126 HydrophobicContact CB-CG 4.16Å; E113-L126 HydrophobicContact CG-CD1 4.34Å; E113-L126 HydrophobicContact CG-CD2 3.8Å; A116-L126 HydrophobicContact CB-CD1 3.26Å; A116-L126 HydrophobicContact CB-CG 4.25Å; L122-L126 WeakPolarHBondContact O-CB 3.49Å; L122-L126 PolarHBondContact O-N 2.9Å; Q123-L126 PolarHBondContact O-N 3.19Å; L126-Y128 VanDerWaalsContact C-N 3.34Å; L126-Y128 PolarHBondContact O-N 2.9Å; L126-L129 PolarHBondContact O-N 3.11Å; L126-Y130 HydrophobicContact CB-CD2 4.36Å; L126-Y130 HydrophobicContact CB-CE2 4.23Å; L126-Y130 HydrophobicContact CD2-CE2 4.04Å; L126-Y130 WeakPolarHBondContact O-CD2 3.4Å; L126-Y130 PolarHBondContact O-N 2.89Å
127	R	55.6	Low	52.5	Low	152 Å²	152	85.3 Å²	85.3	57%	0.574	42%	0.42	S	S	*	.	H	α-helix	trans	-60.6	-45.1	178.9	-174.7	177.7	171.8	-146.2	-13.4	111.1	Q123 D124 N125 L129 Y130 E131	Q123-R127 WeakPolarHBondContact O-CB 3.41Å; Q123-R127 PolarHBondContact O-N 3.33Å; D124-R127 PolarHBondContact O-N 3.21Å; N125-R127 VanDerWaalsContact C-N 3.34Å; R127-L129 PolarHBondContact O-N 3.04Å; R127-Y130 PolarHBondContact O-N 3.44Å; R127-E131 IonicContact CZ-OE1 3.34Å; R127-E131 IonicContact NE-OE1 3.05Å; R127-E131 PolarHBondContact NE-OE1 3.05Å; R127-E131 IonicContact NH2-OE1 2.92Å; R127-E131 PolarHBondContact NH2-OE1 2.63Å; R127-E131 WeakPolarHBondContact O-CB 3.33Å; R127-E131 VanDerWaalsContact O-CG 3.32Å; R127-E131 WeakPolarHBondContact O-CG 3.44Å; R127-E131 PolarHBondContact O-N 3.32Å
128	Y	57.3	Low	53.1	Low	149 Å²	149	83.3 Å²	83.3	58%	0.584	40%	0.4	S	S	*	.	H	α-helix	trans	-59.2	-44.8	174.2	177.2	-100	0	0	0	111.8	D124 N125 L126 E131 E132	D124-Y128 WeakPolarHBondContact O-CB 3.33Å; D124-Y128 PolarHBondContact O-N 3.49Å; N125-Y128 PolarHBondContact O-N 2.93Å; L126-Y128 VanDerWaalsContact C-N 3.34Å; L126-Y128 PolarHBondContact O-N 2.9Å; Y128-E131 PolarHBondContact O-N 3.45Å; Y128-E132 WeakPolarHBondContact O-CB 3.19Å; Y128-E132 PolarHBondContact O-N 3.25Å
129	L	46.4	Very low	53.6	Low	22 Å²	22	78.8 Å²	78.8	12%	0.115	38%	0.378	C	S	.	.	H	α-helix	trans	-68.4	-36.6	178.8	-72.2	168.8	0	0	0	113.2	L105 I109 L112 N125 L126 R127 E132 N133	L105-L129 HydrophobicContact CD2-CB 4.4Å; L105-L129 HydrophobicContact CD2-CD2 3.76Å; I109-L129 HydrophobicContact CD1-CB 4.33Å; I109-L129 HydrophobicContact CG1-CB 3.88Å; I109-L129 HydrophobicContact CG1-CD1 4.35Å; L112-L129 HydrophobicContact CD1-CD1 3.17Å; N125-L129 WeakPolarHBondContact O-CG 3.45Å; N125-L129 PolarHBondContact O-N 3.1Å; L126-L129 PolarHBondContact O-N 3.11Å; R127-L129 PolarHBondContact O-N 3.04Å; L129-E132 PolarHBondContact O-N 3.27Å; L129-N133 VanDerWaalsContact O-CB 3.28Å; L129-N133 WeakPolarHBondContact O-CB 3.43Å; L129-N133 PolarHBondContact O-N 3.08Å
130	Y	57.3	Low	54.6	Low	107 Å²	107	78.5 Å²	78.5	42%	0.42	38%	0.375	S	S	.	.	H	α-helix	trans	-64.8	-43.6	171.7	-76.2	-61.1	0	0	0	111.1	I109 E113 L126 R127 E132 N133 V134	I109-Y130 HydrophobicContact CG2-CE1 4.07Å; E113-Y130 PolarHBondContact OE1-OH 2.94Å; L126-Y130 HydrophobicContact CB-CD2 4.36Å; L126-Y130 HydrophobicContact CB-CE2 4.23Å; L126-Y130 HydrophobicContact CD2-CE2 4.04Å; L126-Y130 WeakPolarHBondContact O-CD2 3.4Å; L126-Y130 PolarHBondContact O-N 2.89Å; R127-Y130 PolarHBondContact O-N 3.44Å; Y130-E132 VanDerWaalsContact C-N 3.27Å; Y130-E132 PolarHBondContact O-N 3.15Å; Y130-N133 PolarHBondContact O-N 3.4Å; Y130-V134 WeakPolarHBondContact O-CB 3.47Å; Y130-V134 VanDerWaalsContact O-CG2 3.27Å; Y130-V134 WeakPolarHBondContact O-CG2 3.24Å; Y130-V134 PolarHBondContact O-N 2.89Å
131	E	65	Low	55.2	Low	84 Å²	84	80.2 Å²	80.2	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-61.9	-36	176	-74.2	179	-172.3	0	0	111.7	R127 Y128 R135	R127-E131 IonicContact CZ-OE1 3.34Å; R127-E131 IonicContact NE-OE1 3.05Å; R127-E131 PolarHBondContact NE-OE1 3.05Å; R127-E131 IonicContact NH2-OE1 2.92Å; R127-E131 PolarHBondContact NH2-OE1 2.63Å; R127-E131 WeakPolarHBondContact O-CB 3.33Å; R127-E131 VanDerWaalsContact O-CG 3.32Å; R127-E131 WeakPolarHBondContact O-CG 3.44Å; R127-E131 PolarHBondContact O-N 3.32Å; Y128-E131 PolarHBondContact O-N 3.45Å; E131-R135 PolarHBondContact O-N 2.69Å
132	E	63.1	Low	55.7	Low	60 Å²	60	74.3 Å²	74.3	28%	0.28	34%	0.344	S	S	.	.	H	α-helix	trans	-73.5	-39.3	175.3	-168.8	64.2	-174.4	0	0	112.6	Y128 L129 Y130 V134 R135 L136	Y128-E132 WeakPolarHBondContact O-CB 3.19Å; Y128-E132 PolarHBondContact O-N 3.25Å; L129-E132 PolarHBondContact O-N 3.27Å; Y130-E132 VanDerWaalsContact C-N 3.27Å; Y130-E132 PolarHBondContact O-N 3.15Å; E132-V134 VanDerWaalsContact C-N 3.35Å; E132-R135 WeakPolarHBondContact O-CB 3.41Å; E132-R135 PolarHBondContact O-N 3.5Å; E132-L136 HydrophobicContact CG-CD1 4.48Å; E132-L136 WeakPolarHBondContact O-CG 3.44Å; E132-L136 PolarHBondContact O-N 2.91Å
133	N	53.2	Low	56.4	Low	17 Å²	17	75.4 Å²	75.4	9%	0.091	35%	0.347	C	S	.	.	H	α-helix	trans	-65.7	-40.5	176.9	-159.9	17.3	0	0	0	111.3	L105 H106 I109 L129 Y130 L136 H137	L105-N133 HydrophobicContact CD2-CB 4.49Å; H106-N133 PolarHBondContact CD2-ND2 3.33Å; H106-N133 PolarHBondContact NE2-ND2 3.38Å; I109-N133 HydrophobicContact CD1-CB 4.12Å; L129-N133 VanDerWaalsContact O-CB 3.28Å; L129-N133 WeakPolarHBondContact O-CB 3.43Å; L129-N133 PolarHBondContact O-N 3.08Å; Y130-N133 PolarHBondContact O-N 3.4Å; N133-L136 PolarHBondContact O-N 2.82Å; N133-H137 PolarHBondContact O-N 2.75Å
134	V	61.5	Low	57	Low	78 Å²	78	74.4 Å²	74.4	47%	0.473	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-46.6	172.4	171.7	0	0	0	0	110.6	Y130 E132 L136 H137 E138	Y130-V134 WeakPolarHBondContact O-CB 3.47Å; Y130-V134 VanDerWaalsContact O-CG2 3.27Å; Y130-V134 WeakPolarHBondContact O-CG2 3.24Å; Y130-V134 PolarHBondContact O-N 2.89Å; E132-V134 VanDerWaalsContact C-N 3.35Å; V134-L136 VanDerWaalsContact C-N 3.28Å; V134-L136 PolarHBondContact O-N 3.45Å; V134-H137 PolarHBondContact O-N 3.33Å; V134-E138 HydrophobicContact CG1-CG 4.26Å; V134-E138 WeakPolarHBondContact CG1-OE1 3.44Å; V134-E138 WeakPolarHBondContact O-CB 3.39Å; V134-E138 WeakPolarHBondContact O-CG 3.11Å; V134-E138 PolarHBondContact O-N 2.91Å
135	R	61.7	Low	57.5	Low	102 Å²	102	71.8 Å²	71.8	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-53.4	-45.1	174.6	-95.9	-159.2	-162.7	-131.9	8	112.5	E131 E132 K139 V169	E131-R135 PolarHBondContact O-N 2.69Å; E132-R135 WeakPolarHBondContact O-CB 3.41Å; E132-R135 PolarHBondContact O-N 3.5Å; R135-K139 WeakPolarHBondContact O-CB 3.21Å; R135-K139 PolarHBondContact O-N 2.86Å; R135-V169 HydrophobicContact CG-CG1 4.09Å
136	L	62.1	Low	57.8	Low	32 Å²	32	70 Å²	70	17%	0.168	32%	0.322	C	S	.	.	H	α-helix	trans	-70.2	-40.6	-176.8	-73.3	169.8	0	0	0	111.7	L105 E132 N133 V134 K139 D140	L105-L136 HydrophobicContact CD1-CD1 3.67Å; E132-L136 HydrophobicContact CG-CD1 4.48Å; E132-L136 WeakPolarHBondContact O-CG 3.44Å; E132-L136 PolarHBondContact O-N 2.91Å; N133-L136 PolarHBondContact O-N 2.82Å; V134-L136 VanDerWaalsContact C-N 3.28Å; V134-L136 PolarHBondContact O-N 3.45Å; L136-K139 WeakPolarHBondContact O-CB 3.3Å; L136-K139 PolarHBondContact O-N 3.47Å; L136-D140 PolarHBondContact O-N 3.35Å
137	H	62	Low	58.3	Low	85 Å²	85	74.4 Å²	74.4	39%	0.394	34%	0.337	S	S	.	.	H	α-helix	trans	-65.8	-41.7	174.6	-90.9	-66.7	0	0	0	112.5	N133 V134 K139 D140 E141	N133-H137 PolarHBondContact O-N 2.75Å; V134-H137 PolarHBondContact O-N 3.33Å; H137-K139 VanDerWaalsContact C-N 3.29Å; H137-K139 PolarHBondContact O-N 3.31Å; H137-D140 PolarHBondContact O-N 3.3Å; H137-E141 PolarHBondContact O-N 3.43Å
138	E	60.9	Low	58.3	Low	56 Å²	56	73.9 Å²	73.9	26%	0.262	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-39	172.7	-72.6	174.4	173.6	0	0	110.9	V134 D140 E141 I142 V169	V134-E138 HydrophobicContact CG1-CG 4.26Å; V134-E138 WeakPolarHBondContact CG1-OE1 3.44Å; V134-E138 WeakPolarHBondContact O-CB 3.39Å; V134-E138 WeakPolarHBondContact O-CG 3.11Å; V134-E138 PolarHBondContact O-N 2.91Å; E138-D140 VanDerWaalsContact C-N 3.35Å; E138-D140 PolarHBondContact O-N 3.04Å; E138-E141 PolarHBondContact O-N 3.44Å; E138-I142 WeakPolarHBondContact O-CB 3.4Å; E138-I142 WeakPolarHBondContact O-CD1 3.12Å; E138-I142 WeakPolarHBondContact O-CG1 3.48Å; E138-I142 PolarHBondContact O-N 2.98Å; E138-V169 HydrophobicContact CB-CG2 4.36Å
139	K	59.2	Low	58.1	Low	30 Å²	30	74 Å²	74	13%	0.13	35%	0.351	C	S	.	.	H	α-helix	trans	-60.8	-42.9	175.1	-162.8	179.1	-175.9	167.5	0	111.6	R135 L136 H137 K143 E162 V165	R135-K139 WeakPolarHBondContact O-CB 3.21Å; R135-K139 PolarHBondContact O-N 2.86Å; L136-K139 WeakPolarHBondContact O-CB 3.3Å; L136-K139 PolarHBondContact O-N 3.47Å; H137-K139 VanDerWaalsContact C-N 3.29Å; H137-K139 PolarHBondContact O-N 3.31Å; K139-K143 WeakPolarHBondContact O-CB 3.46Å; K139-K143 WeakPolarHBondContact O-CG 2.86Å; K139-K143 PolarHBondContact O-N 3.4Å; K139-E162 IonicContact NZ-OE1 4Å; K139-E162 PolarHBondContact NZ-OE1 3.09Å; K139-V165 HydrophobicContact CB-CG1 4Å; K139-V165 HydrophobicContact CG-CB 4.26Å; K139-V165 HydrophobicContact CG-CG1 3.42Å; K139-V165 VanDerWaalsContact CG-CG1 3.42Å
140	D	62.9	Low	58.4	Low	59 Å²	59	77.3 Å²	77.3	32%	0.316	37%	0.369	S	S	.	.	H	α-helix	trans	-68.1	-45.1	177.9	-79.9	-10.2	0	0	0	111.6	I102 L136 H137 E138 I142 K143 E144	I102-D140 WeakPolarHBondContact CD1-OD2 3.39Å; L136-D140 PolarHBondContact O-N 3.35Å; H137-D140 PolarHBondContact O-N 3.3Å; E138-D140 VanDerWaalsContact C-N 3.35Å; E138-D140 PolarHBondContact O-N 3.04Å; D140-I142 VanDerWaalsContact C-N 3.34Å; D140-I142 PolarHBondContact O-N 2.55Å; D140-K143 PolarHBondContact O-N 2.94Å; D140-E144 WeakPolarHBondContact O-CB 3.32Å; D140-E144 PolarHBondContact O-N 3.27Å
141	E	59.2	Low	58	Low	135 Å²	135	75.7 Å²	75.7	63%	0.631	39%	0.385	S	S	*	.	H	α-helix	trans	-61.8	-41.3	177.2	-76.2	-172.4	171.8	0	0	112	H137 E138 E144 S145	H137-E141 PolarHBondContact O-N 3.43Å; E138-E141 PolarHBondContact O-N 3.44Å; E141-E144 PolarHBondContact O-N 3.24Å; E141-S145 VanDerWaalsContact O-CB 3.29Å; E141-S145 WeakPolarHBondContact O-CB 3.23Å; E141-S145 PolarHBondContact O-N 3.37Å; E141-S145 PolarHBondContact O-OG 3.25Å
142	I	55.8	Low	57.2	Low	12 Å²	12	74.6 Å²	74.6	6%	0.062	40%	0.396	C	S	.	.	H	α-helix	trans	-65.7	-44.5	176.4	-68.8	164	0	0	0	110.8	E138 D140 E144 S145 H146 V165 E168 V169	E138-I142 WeakPolarHBondContact O-CB 3.4Å; E138-I142 WeakPolarHBondContact O-CD1 3.12Å; E138-I142 WeakPolarHBondContact O-CG1 3.48Å; E138-I142 PolarHBondContact O-N 2.98Å; D140-I142 VanDerWaalsContact C-N 3.34Å; D140-I142 PolarHBondContact O-N 2.55Å; I142-E144 PolarHBondContact O-N 2.9Å; I142-S145 WeakPolarHBondContact O-CB 3.38Å; I142-S145 PolarHBondContact O-N 3.02Å; I142-H146 PolarHBondContact O-CD2 3.41Å; I142-H146 PolarHBondContact O-N 3.42Å; I142-V165 HydrophobicContact CB-CG1 4.08Å; I142-V165 HydrophobicContact CD1-CG1 4.11Å; I142-V165 HydrophobicContact CG2-CB 4.4Å; I142-V165 HydrophobicContact CG2-CG1 3.99Å; I142-V165 HydrophobicContact CG2-CG2 3.88Å; I142-E168 HydrophobicContact CD1-CB 3.88Å; I142-E168 WeakPolarHBondContact CG2-OE2 3.45Å; I142-V169 HydrophobicContact CD1-CG2 3.92Å
143	K	57.6	Low	56.3	Low	51 Å²	51	78.6 Å²	78.6	22%	0.222	42%	0.415	C	S	.	.	H	α-helix	trans	-61.7	-43	176.3	-83.2	-173.1	175.1	-172	0	112.2	K139 D140 S145 H146 R147 V161 V165	K139-K143 WeakPolarHBondContact O-CB 3.46Å; K139-K143 WeakPolarHBondContact O-CG 2.86Å; K139-K143 PolarHBondContact O-N 3.4Å; D140-K143 PolarHBondContact O-N 2.94Å; K143-S145 VanDerWaalsContact C-N 3.32Å; K143-H146 PolarHBondContact O-N 3.06Å; K143-R147 WeakPolarHBondContact O-CB 2.91Å; K143-R147 PolarHBondContact O-N 2.98Å; K143-V161 HydrophobicContact CG-CG1 4.17Å; K143-V165 HydrophobicContact CG-CG2 4.07Å
144	E	59.2	Low	55.9	Low	111 Å²	111	81.1 Å²	81.1	52%	0.519	43%	0.427	S	S	.	.	H	α-helix	trans	-63.4	-41.7	176.8	-158.8	79.9	-175.3	0	0	110.4	D140 E141 I142 R147 L148	D140-E144 WeakPolarHBondContact O-CB 3.32Å; D140-E144 PolarHBondContact O-N 3.27Å; E141-E144 PolarHBondContact O-N 3.24Å; I142-E144 PolarHBondContact O-N 2.9Å; E144-R147 WeakPolarHBondContact O-CB 2.92Å; E144-R147 PolarHBondContact O-N 3.42Å; E144-L148 HydrophobicContact CG-CD1 4.42Å; E144-L148 WeakPolarHBondContact O-CB 3.38Å; E144-L148 WeakPolarHBondContact O-CD1 3.38Å; E144-L148 WeakPolarHBondContact O-CG 3.48Å; E144-L148 PolarHBondContact O-N 3.45Å
145	S	55.9	Low	55.2	Low	61 Å²	61	84.5 Å²	84.5	43%	0.427	44%	0.443	S	S	.	.	H	α-helix	trans	-62.5	-45.6	176.5	-57.9	0	0	0	0	112.3	E141 I142 K143 L148 Q149	E141-S145 VanDerWaalsContact O-CB 3.29Å; E141-S145 WeakPolarHBondContact O-CB 3.23Å; E141-S145 PolarHBondContact O-N 3.37Å; E141-S145 PolarHBondContact O-OG 3.25Å; I142-S145 WeakPolarHBondContact O-CB 3.38Å; I142-S145 PolarHBondContact O-N 3.02Å; K143-S145 VanDerWaalsContact C-N 3.32Å; S145-L148 PolarHBondContact O-N 3.03Å; S145-Q149 WeakPolarHBondContact O-CG 3.37Å; S145-Q149 PolarHBondContact O-N 2.94Å
146	H	54.3	Low	54.6	Low	48 Å²	48	81.4 Å²	81.4	22%	0.222	44%	0.437	C	S	.	.	H	α-helix	trans	-66	-39.3	175.8	-89.1	-78.7	0	0	0	112	I142 K143 L148 Q149 N150 E168	I142-H146 PolarHBondContact O-CD2 3.41Å; I142-H146 PolarHBondContact O-N 3.42Å; K143-H146 PolarHBondContact O-N 3.06Å; H146-L148 VanDerWaalsContact C-N 3.33Å; H146-L148 PolarHBondContact O-N 3.39Å; H146-Q149 PolarHBondContact O-N 3.19Å; H146-N150 PolarHBondContact O-N 3.02Å; H146-E168 IonicContact CD2-OE1 2.74Å; H146-E168 IonicContact CE1-OE1 3.81Å; H146-E168 IonicContact NE2-OE1 2.94Å; H146-E168 PolarHBondContact NE2-OE1 2.81Å; H146-E168 IonicContact NE2-OE2 3.95Å
147	R	53.7	Low	54.1	Low	112 Å²	112	84.2 Å²	84.2	42%	0.423	46%	0.456	S	S	.	.	H	α-helix	trans	-58.8	-43.7	172.7	-99.8	-177	159.3	-177.6	-3.8	112	E95 K143 E144 G151 G152 I154	E95-R147 IonicContact OE1-NH1 3.8Å; K143-R147 WeakPolarHBondContact O-CB 2.91Å; K143-R147 PolarHBondContact O-N 2.98Å; E144-R147 WeakPolarHBondContact O-CB 2.92Å; E144-R147 PolarHBondContact O-N 3.42Å; R147-G151 PolarHBondContact O-N 2.88Å; R147-G152 PolarHBondContact O-N 3.14Å; R147-I154 HydrophobicContact CG-CD1 3.77Å
148	L	56.2	Low	53.5	Low	140 Å²	140	86.8 Å²	86.8	73%	0.733	47%	0.472	S	S	*	.	H	α-helix	trans	-68.8	-36.1	178.6	-75.3	163.1	0	0	0	112.3	E144 S145 H146	E144-L148 HydrophobicContact CG-CD1 4.42Å; E144-L148 WeakPolarHBondContact O-CB 3.38Å; E144-L148 WeakPolarHBondContact O-CD1 3.38Å; E144-L148 WeakPolarHBondContact O-CG 3.48Å; E144-L148 PolarHBondContact O-N 3.45Å; S145-L148 PolarHBondContact O-N 3.03Å; H146-L148 VanDerWaalsContact C-N 3.33Å; H146-L148 PolarHBondContact O-N 3.39Å
149	Q	52.6	Low	53.2	Low	152 Å²	152	91.6 Å²	91.6	71%	0.71	50%	0.495	S	S	*	.	H	α-helix	trans	-73.5	-41.3	178.2	-77.6	-174	4.1	0	0	113.2	S145 H146 G151	S145-Q149 WeakPolarHBondContact O-CG 3.37Å; S145-Q149 PolarHBondContact O-N 2.94Å; H146-Q149 PolarHBondContact O-N 3.19Å; Q149-G151 VanDerWaalsContact C-N 3.32Å; Q149-G151 PolarHBondContact O-N 3.49Å
150	N	52.9	Low	53.1	Low	91 Å²	91	95 Å²	95	49%	0.487	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	17	-174.2	-69.5	-20.2	0	0	0	114.1	H146 G152 H153	H146-N150 PolarHBondContact O-N 3.02Å; N150-G152 PolarHBondContact O-N 3.07Å; N150-G152 VanDerWaalsContact O-N 3.09Å; N150-H153 PolarHBondContact O-N 3.41Å; N150-H153 VanDerWaalsContact O-N 3.11Å
151	G	49.4	Very low	52.7	Low	74 Å²	74	93.3 Å²	93.3	76%	0.763	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	27.9	170.3	0	0	0	0	0	114.5	R147 Q149 H153	R147-G151 PolarHBondContact O-N 2.88Å; Q149-G151 VanDerWaalsContact C-N 3.32Å; Q149-G151 PolarHBondContact O-N 3.49Å; G151-H153 VanDerWaalsContact C-N 3.32Å; G151-H153 PolarHBondContact O-N 3.17Å
152	G	47.3	Very low	52.6	Low	61 Å²	61	90.4 Å²	90.4	63%	0.629	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	8.3	-179.9	0	0	0	0	0	115.8	R147 N150	R147-G152 PolarHBondContact O-N 3.14Å; N150-G152 PolarHBondContact O-N 3.07Å; N150-G152 VanDerWaalsContact O-N 3.09Å
153	H	44.4	Very low	53.1	Low	144 Å²	144	96.3 Å²	96.3	67%	0.667	52%	0.517	S	S	*	.			trans	-106.8	90.8	176.1	-137.2	60.1	0	0	0	109.7	N150 G151	N150-H153 PolarHBondContact O-N 3.41Å; N150-H153 VanDerWaalsContact O-N 3.11Å; G151-H153 VanDerWaalsContact C-N 3.32Å; G151-H153 PolarHBondContact O-N 3.17Å
154	I	44.6	Very low	53.2	Low	69 Å²	69	97.4 Å²	97.4	35%	0.354	52%	0.524	S	S	.	.			trans	-107.7	95.1	174.8	-58.3	175.7	0	0	0	106.8	R147 S156 V161	R147-I154 HydrophobicContact CG-CD1 3.77Å; I154-S156 VanDerWaalsContact C-N 3.3Å; I154-S156 WeakPolarHBondContact CG2-OG 3.44Å; I154-V161 HydrophobicContact CG2-CG2 4Å
155	D	47.2	Very low	53	Low	149 Å²	149	92.2 Å²	92.2	80%	0.797	50%	0.5	S	S	*	.			trans	-88	2.4	174.5	-110.6	-0.5	0	0	0	112.3
156	S	50.1	Low	53.2	Low	37 Å²	37	93.8 Å²	93.8	26%	0.259	50%	0.5	S	S	.	.	S	Bend	trans	-82.7	130.1	174.3	56.9	0	0	0	0	110	I154 E160 V161	I154-S156 VanDerWaalsContact C-N 3.3Å; I154-S156 WeakPolarHBondContact CG2-OG 3.44Å; S156-E160 WeakPolarHBondContact CB-OE2 3.2Å; S156-V161 WeakPolarHBondContact OG-CG2 3.39Å
157	T	50.2	Low	53.7	Low	92 Å²	92	97.6 Å²	97.6	56%	0.564	52%	0.519	S	S	*	.			trans	-57.3	145.3	178.2	46	0	0	0	0	110.9	E159 E160 V161	T157-E159 PolarHBondContact O-N 3.21Å; T157-E160 PolarHBondContact O-N 2.58Å; T157-V161 PolarHBondContact O-N 3.16Å
158	D	51	Low	53.6	Low	138 Å²	138	95.1 Å²	95.1	74%	0.738	51%	0.512	S	S	*	.	H	α-helix	trans	-48.2	-30.9	-175.7	-74.7	-42.9	0	0	0	113.8	E162	D158-E162 WeakPolarHBondContact O-CG 3.41Å; D158-E162 PolarHBondContact O-N 2.99Å
159	E	54.4	Low	53.3	Low	158 Å²	158	88.8 Å²	88.8	74%	0.738	48%	0.479	S	S	*	.	H	α-helix	trans	-65.1	-39	175.1	-66.7	-176.4	173.6	0	0	113.5	T157 E162 E163	T157-E159 PolarHBondContact O-N 3.21Å; E159-E162 PolarHBondContact O-N 3.28Å; E159-E163 PolarHBondContact O-N 3.38Å
160	E	56.7	Low	53.3	Low	101 Å²	101	89.1 Å²	89.1	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-69.5	-38.4	177.8	-74	-176.9	160.4	0	0	111	S156 T157 E162 E163 I164	S156-E160 WeakPolarHBondContact CB-OE2 3.2Å; T157-E160 PolarHBondContact O-N 2.58Å; E160-E162 VanDerWaalsContact C-N 3.32Å; E160-E163 PolarHBondContact O-N 3.44Å; E160-I164 WeakPolarHBondContact O-CB 3.36Å; E160-I164 VanDerWaalsContact O-CG1 3.24Å; E160-I164 WeakPolarHBondContact O-CG1 3.34Å; E160-I164 PolarHBondContact O-N 3.06Å
161	V	54.8	Low	53.1	Low	24 Å²	24	88.9 Å²	88.9	15%	0.145	48%	0.476	C	S	.	.	H	α-helix	trans	-64.8	-40.5	174.5	-177	0	0	0	0	110.1	K143 I154 S156 T157 V165	K143-V161 HydrophobicContact CG-CG1 4.17Å; I154-V161 HydrophobicContact CG2-CG2 4Å; S156-V161 WeakPolarHBondContact OG-CG2 3.39Å; T157-V161 PolarHBondContact O-N 3.16Å; V161-V165 HydrophobicContact CG1-CG2 4.15Å; V161-V165 WeakPolarHBondContact O-CB 3.26Å; V161-V165 WeakPolarHBondContact O-CG2 3.36Å; V161-V165 PolarHBondContact O-N 2.7Å
162	E	56.3	Low	52.6	Low	73 Å²	73	92.3 Å²	92.3	34%	0.341	47%	0.466	S	S	.	.	H	α-helix	trans	-63.3	-41.4	173.8	-72.5	-153.4	131.3	0	0	112.5	K139 D158 E159 E160 V165 E166	K139-E162 IonicContact NZ-OE1 4Å; K139-E162 PolarHBondContact NZ-OE1 3.09Å; D158-E162 WeakPolarHBondContact O-CG 3.41Å; D158-E162 PolarHBondContact O-N 2.99Å; E159-E162 PolarHBondContact O-N 3.28Å; E160-E162 VanDerWaalsContact C-N 3.32Å; E162-V165 PolarHBondContact O-N 2.84Å; E162-E166 WeakPolarHBondContact O-CB 3.45Å; E162-E166 WeakPolarHBondContact O-CG 3.33Å; E162-E166 PolarHBondContact O-N 2.89Å
163	E	67	Low	52.3	Low	137 Å²	137	95 Å²	95	64%	0.64	46%	0.461	S	S	*	.	H	α-helix	trans	-66.4	-44.8	179.2	-164.4	170.7	-160.8	0	0	112.2	E159 E160 V165 E166 E167	E159-E163 PolarHBondContact O-N 3.38Å; E160-E163 PolarHBondContact O-N 3.44Å; E163-V165 PolarHBondContact O-N 3.42Å; E163-E166 PolarHBondContact O-N 3.03Å; E163-E167 WeakPolarHBondContact O-CB 3.29Å; E163-E167 PolarHBondContact O-N 3Å
164	I	59.8	Low	52.1	Low	74 Å²	74	96.8 Å²	96.8	38%	0.379	47%	0.467	S	S	.	.	H	α-helix	trans	-60.6	-46.1	175.5	-68.5	165.4	0	0	0	110.5	E160 E166 E167 E168	E160-I164 WeakPolarHBondContact O-CB 3.36Å; E160-I164 VanDerWaalsContact O-CG1 3.24Å; E160-I164 WeakPolarHBondContact O-CG1 3.34Å; E160-I164 PolarHBondContact O-N 3.06Å; I164-E166 VanDerWaalsContact C-N 3.34Å; I164-E166 PolarHBondContact O-N 3.45Å; I164-E167 PolarHBondContact O-N 2.69Å; I164-E168 PolarHBondContact O-N 2.89Å
165	V	54.8	Low	51.2	Low	2 Å²	2	96.3 Å²	96.3	1%	0.012	47%	0.473	C	S	.	.	H	α-helix	trans	-69.3	-36.3	-178.9	-173.8	0	0	0	0	110.8	K139 I142 K143 V161 E162 E163 E167 E168 V169	K139-V165 HydrophobicContact CB-CG1 4Å; K139-V165 HydrophobicContact CG-CB 4.26Å; K139-V165 HydrophobicContact CG-CG1 3.42Å; K139-V165 VanDerWaalsContact CG-CG1 3.42Å; I142-V165 HydrophobicContact CB-CG1 4.08Å; I142-V165 HydrophobicContact CD1-CG1 4.11Å; I142-V165 HydrophobicContact CG2-CB 4.4Å; I142-V165 HydrophobicContact CG2-CG1 3.99Å; I142-V165 HydrophobicContact CG2-CG2 3.88Å; K143-V165 HydrophobicContact CG-CG2 4.07Å; V161-V165 HydrophobicContact CG1-CG2 4.15Å; V161-V165 WeakPolarHBondContact O-CB 3.26Å; V161-V165 WeakPolarHBondContact O-CG2 3.36Å; V161-V165 PolarHBondContact O-N 2.7Å; E162-V165 PolarHBondContact O-N 2.84Å; E163-V165 PolarHBondContact O-N 3.42Å; V165-E167 VanDerWaalsContact C-N 3.29Å; V165-E167 PolarHBondContact O-N 3.41Å; V165-E168 PolarHBondContact O-N 3.22Å; V165-V169 HydrophobicContact CG1-CG2 4.21Å; V165-V169 WeakPolarHBondContact O-CB 3.42Å; V165-V169 VanDerWaalsContact O-CG2 3.26Å; V165-V169 WeakPolarHBondContact O-CG2 3.46Å; V165-V169 PolarHBondContact O-N 3.3Å
166	E	60.5	Low	50.4	Low	93 Å²	93	94.8 Å²	94.8	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-64.7	-32.8	173	-80.8	-161.3	175.3	0	0	113.2	E162 E163 I164 R170	E162-E166 WeakPolarHBondContact O-CB 3.45Å; E162-E166 WeakPolarHBondContact O-CG 3.33Å; E162-E166 PolarHBondContact O-N 2.89Å; E163-E166 PolarHBondContact O-N 3.03Å; I164-E166 VanDerWaalsContact C-N 3.34Å; I164-E166 PolarHBondContact O-N 3.45Å; E166-R170 WeakPolarHBondContact O-CB 3.21Å; E166-R170 PolarHBondContact O-N 3.44Å
167	E	63.4	Low	49.4	Very low	129 Å²	129	102.7 Å²	102.7	60%	0.603	50%	0.501	S	S	*	.	H	α-helix	trans	-73.3	-39.9	174.9	-163.1	170.5	-164	0	0	111.9	E163 I164 V165 R170 T171	E163-E167 WeakPolarHBondContact O-CB 3.29Å; E163-E167 PolarHBondContact O-N 3Å; I164-E167 PolarHBondContact O-N 2.69Å; V165-E167 VanDerWaalsContact C-N 3.29Å; V165-E167 PolarHBondContact O-N 3.41Å; E167-R170 WeakPolarHBondContact O-CB 3.45Å; E167-R170 PolarHBondContact O-N 3.09Å; E167-T171 PolarHBondContact O-N 3.03Å; E167-T171 PolarHBondContact O-OG1 3.35Å; E167-T171 VanDerWaalsContact O-OG1 3.05Å
168	E	51.7	Low	48.2	Very low	59 Å²	59	104.7 Å²	104.7	28%	0.276	51%	0.513	S	S	.	.	H	α-helix	trans	-66.9	-43.9	174.4	-80.2	-169.4	-163.8	0	0	112.7	I142 H146 I164 V165 R170 T171 Y172	I142-E168 HydrophobicContact CD1-CB 3.88Å; I142-E168 WeakPolarHBondContact CG2-OE2 3.45Å; H146-E168 IonicContact CD2-OE1 2.74Å; H146-E168 IonicContact CE1-OE1 3.81Å; H146-E168 IonicContact NE2-OE1 2.94Å; H146-E168 PolarHBondContact NE2-OE1 2.81Å; H146-E168 IonicContact NE2-OE2 3.95Å; I164-E168 PolarHBondContact O-N 2.89Å; V165-E168 PolarHBondContact O-N 3.22Å; E168-R170 PolarHBondContact O-N 3.29Å; E168-T171 VanDerWaalsContact CA-OG1 3.25Å; E168-T171 WeakPolarHBondContact CA-OG1 3.35Å; E168-T171 PolarHBondContact O-N 3.28Å; E168-T171 VanDerWaalsContact O-N 3.1Å; E168-T171 PolarHBondContact O-OG1 3.47Å; E168-Y172 PolarHBondContact O-N 3.01Å
169	V	50	Low	47	Very low	7 Å²	7	105.3 Å²	105.3	4%	0.042	52%	0.516	C	S	.	.	H	α-helix	trans	-62	-34.1	173.5	171.5	0	0	0	0	110.7	R135 E138 I142 V165 T171 K173	R135-V169 HydrophobicContact CG-CG1 4.09Å; E138-V169 HydrophobicContact CB-CG2 4.36Å; I142-V169 HydrophobicContact CD1-CG2 3.92Å; V165-V169 HydrophobicContact CG1-CG2 4.21Å; V165-V169 WeakPolarHBondContact O-CB 3.42Å; V165-V169 VanDerWaalsContact O-CG2 3.26Å; V165-V169 WeakPolarHBondContact O-CG2 3.46Å; V165-V169 PolarHBondContact O-N 3.3Å; V169-T171 VanDerWaalsContact C-N 3.35Å; V169-K173 PolarHBondContact O-N 2.86Å; V169-K173 VanDerWaalsContact O-N 3.1Å
170	R	53.6	Low	45.7	Very low	160 Å²	160	103.7 Å²	103.7	60%	0.604	52%	0.519	S	S	*	.	H	α-helix	trans	-67	-35	175.1	-123.4	-179.5	-70.4	-169.2	-3.2	112.6	E166 E167 E168	E166-R170 WeakPolarHBondContact O-CB 3.21Å; E166-R170 PolarHBondContact O-N 3.44Å; E167-R170 WeakPolarHBondContact O-CB 3.45Å; E167-R170 PolarHBondContact O-N 3.09Å; E168-R170 PolarHBondContact O-N 3.29Å
171	T	47.6	Very low	44.1	Very low	86 Å²	86	105.1 Å²	105.1	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-77.6	-38.2	176.7	37.9	0	0	0	0	111.6	E167 E168 V169 K173 K174	E167-T171 PolarHBondContact O-N 3.03Å; E167-T171 PolarHBondContact O-OG1 3.35Å; E167-T171 VanDerWaalsContact O-OG1 3.05Å; E168-T171 VanDerWaalsContact CA-OG1 3.25Å; E168-T171 WeakPolarHBondContact CA-OG1 3.35Å; E168-T171 PolarHBondContact O-N 3.28Å; E168-T171 VanDerWaalsContact O-N 3.1Å; E168-T171 PolarHBondContact O-OG1 3.47Å; V169-T171 VanDerWaalsContact C-N 3.35Å; T171-K173 VanDerWaalsContact C-N 3.35Å; T171-K173 PolarHBondContact O-N 3.44Å; T171-K174 WeakPolarHBondContact O-CB 3.35Å; T171-K174 PolarHBondContact O-N 3.18Å
172	Y	40.1	Very low	42.6	Very low	146 Å²	146	108.5 Å²	108.5	57%	0.573	57%	0.565	S	S	*	*	H	α-helix	trans	-60.5	-39.2	173	-97.4	-82.1	0	0	0	113	E168 K174 A175	E168-Y172 PolarHBondContact O-N 3.01Å; Y172-K174 PolarHBondContact O-N 3.28Å; Y172-K174 VanDerWaalsContact O-N 3.09Å; Y172-A175 WeakPolarHBondContact O-CB 3.28Å; Y172-A175 PolarHBondContact O-N 3.3Å
173	K	39.9	Very low	41.2	Very low	116 Å²	116	111.5 Å²	111.5	50%	0.504	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.9	-18.1	173.2	-79.3	-171.6	177.8	-172.9	0	114.4	V169 T171	V169-K173 PolarHBondContact O-N 2.86Å; V169-K173 VanDerWaalsContact O-N 3.1Å; T171-K173 VanDerWaalsContact C-N 3.35Å; T171-K173 PolarHBondContact O-N 3.44Å
174	K	39.8	Very low	39.1	Very low	183 Å²	183	112.7 Å²	112.7	80%	0.796	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-6.6	174.9	-68	-178.5	178.4	177.7	0	113.1	T171 Y172	T171-K174 WeakPolarHBondContact O-CB 3.35Å; T171-K174 PolarHBondContact O-N 3.18Å; Y172-K174 PolarHBondContact O-N 3.28Å; Y172-K174 VanDerWaalsContact O-N 3.09Å
175	A	27.1	Very low	37.4	Very low	59 Å²	59	117.1 Å²	117.1	49%	0.488	62%	0.618	S	S	.	*	S	Bend	trans	-77.5	135.3	175.2	0	0	0	0	0	111.2	Y172 K177	Y172-A175 WeakPolarHBondContact O-CB 3.28Å; Y172-A175 PolarHBondContact O-N 3.3Å; A175-K177 PolarHBondContact O-N 2.86Å
176	P	30.4	Very low	35.8	Very low	116 Å²	116	122.6 Å²	122.6	75%	0.753	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-69.9	130.5	-175.9	25.8	-31.6	0	0	0	112	T178	P176-T178 PolarHBondContact O-N 3.44Å
177	K	27.9	Very low	34	Very low	203 Å²	203	122 Å²	122	88%	0.883	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-53.5	117.4	174.4	-64.7	178.5	177.8	-177.3	0	110.1	A175	A175-K177 PolarHBondContact O-N 2.86Å
178	T	26.1	Very low	32.1	Very low	134 Å²	134	121.9 Å²	121.9	82%	0.822	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-93.1	130.6	169.2	44.1	0	0	0	0	108.8	P176	P176-T178 PolarHBondContact O-N 3.44Å
179	D	25.7	Very low	30.8	Very low	151 Å²	151	125.9 Å²	125.9	81%	0.807	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-65.5	126.6	-172.7	-69.2	-45.1	0	0	0	111.9	V181	D179-V181 PolarHBondContact O-N 3.17Å
180	P	26.6	Very low	29.6	Very low	124 Å²	124	133.8 Å²	133.8	81%	0.805	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-76.5	118.3	177.4	28.6	-29.9	0	0	0	110.4
181	V	24.2	Very low	28.4	Very low	131 Å²	131	134.6 Å²	134.6	79%	0.794	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-61.5	131.7	172.3	175.2	0	0	0	0	110.1	D179 N183	D179-V181 PolarHBondContact O-N 3.17Å; V181-N183 PolarHBondContact O-N 3.14Å
182	A	23.3	Very low	27.4	Very low	95 Å²	95	133.4 Å²	133.4	79%	0.785	75%	0.749	S	S	*	*			trans	-53.7	109.8	-179.1	0	0	0	0	0	113.4
183	N	25.1	Very low	26.9	Very low	136 Å²	136	131.6 Å²	131.6	73%	0.727	75%	0.75	S	S	*	*			trans	-126	104.9	160.1	-82.1	-28.2	0	0	0	108.4	V181 L185	V181-N183 PolarHBondContact O-N 3.14Å; N183-L185 PolarHBondContact O-N 3Å
184	D	24.3	Very low	26.6	Very low	163 Å²	163	131.5 Å²	131.5	87%	0.872	75%	0.754	S	S	*	*			trans	25.2	73.3	149.5	-60.3	-27.7	0	0	0	118.1
185	L	22.8	Very low	26.4	Very low	167 Å²	167	129.6 Å²	129.6	87%	0.874	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-78.7	124.7	155.4	-100.8	93.9	0	0	0	109.5	N183 S187	N183-L185 PolarHBondContact O-N 3Å; L185-S187 PolarHBondContact O-N 3.4Å
186	P	21.5	Very low	27.1	Very low	117 Å²	117	133.2 Å²	133.2	76%	0.76	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-70.2	131.1	-178.2	27.1	-31.5	0	0	0	111.5
187	S	22.6	Very low	27.5	Very low	80 Å²	80	129.4 Å²	129.4	56%	0.559	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-62.9	152.7	-177.5	65.2	0	0	0	0	113.9	L185 N189	L185-S187 PolarHBondContact O-N 3.4Å; S187-N189 PolarHBondContact O-N 3.17Å
188	P	24.8	Very low	28.2	Very low	127 Å²	127	121.3 Å²	121.3	83%	0.825	71%	0.711	S	S	*	*	S	Bend	trans	-75.4	13.9	-164.8	-10.6	28	0	0	0	116.3	H190	P188-H190 VanDerWaalsContact C-N 3.34Å; P188-H190 PolarHBondContact O-N 3.19Å; P188-H190 VanDerWaalsContact O-N 3.14Å
189	N	23.8	Very low	29.3	Very low	142 Å²	142	119.3 Å²	119.3	76%	0.759	70%	0.696	S	S	*	*			trans	-89.4	36.2	-165.3	-75.5	-23	0	0	0	115.2	S187	S187-N189 PolarHBondContact O-N 3.17Å
190	H	23.8	Very low	30.2	Very low	174 Å²	174	116.7 Å²	116.7	81%	0.806	68%	0.677	S	S	*	*			trans	-104.4	60.6	176.9	-74	-63.2	0	0	0	113.4	P188	P188-H190 VanDerWaalsContact C-N 3.34Å; P188-H190 PolarHBondContact O-N 3.19Å; P188-H190 VanDerWaalsContact O-N 3.14Å
191	L	29.6	Very low	31.5	Very low	177 Å²	177	115 Å²	115	93%	0.927	67%	0.669	S	S	*	*			trans	-104.1	90	152	-89.8	159.5	0	0	0	107.6	N193	L191-N193 PolarHBondContact O-N 3.16Å
192	G	27.2	Very low	32.6	Very low	60 Å²	60	115.2 Å²	115.2	62%	0.619	66%	0.661	S	S	*	*			trans	-53.2	132.7	-176.4	0	0	0	0	0	112.2	L194	G192-L194 PolarHBondContact O-N 3.27Å
193	N	29.3	Very low	33.8	Very low	109 Å²	109	114.1 Å²	114.1	58%	0.583	64%	0.639	S	S	*	*			trans	-12.7	95.6	160.5	-155.7	-7.9	0	0	0	113.3	L191 N195 N196	L191-N193 PolarHBondContact O-N 3.16Å; N193-N195 PolarHBondContact O-N 3.31Å; N193-N195 PolarHBondContact OD1-ND2 2.91Å; N193-N196 WeakPolarHBondContact O-CB 3.42Å; N193-N196 PolarHBondContact O-N 2.84Å
194	L	32.5	Very low	35.1	Very low	114 Å²	114	112 Å²	112	60%	0.597	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-6.2	-176.4	-78.2	164.4	0	0	0	114.4	G192 N196 I198 V335	G192-L194 PolarHBondContact O-N 3.27Å; L194-N196 PolarHBondContact O-N 3.4Å; L194-I198 HydrophobicContact CD2-CG1 4.28Å; L194-V335 HydrophobicContact CD1-CG1 4.22Å
195	N	36.9	Very low	36.6	Very low	143 Å²	143	108.2 Å²	108.2	77%	0.765	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-26.5	165.9	-71.4	-25.6	0	0	0	112.1	N193 G197	N193-N195 PolarHBondContact O-N 3.31Å; N193-N195 PolarHBondContact OD1-ND2 2.91Å; N195-G197 VanDerWaalsContact C-N 3.28Å; N195-G197 PolarHBondContact O-N 3.43Å
196	N	40.6	Very low	38.1	Very low	135 Å²	135	106.5 Å²	106.5	72%	0.722	61%	0.606	S	S	*	*	S	Bend	trans	-76.7	87	163.9	-68	-7.5	0	0	0	106.7	N193 L194	N193-N196 WeakPolarHBondContact O-CB 3.42Å; N193-N196 PolarHBondContact O-N 2.84Å; L194-N196 PolarHBondContact O-N 3.4Å
197	G	38.4	Very low	39.5	Very low	35 Å²	35	106.2 Å²	106.2	36%	0.361	59%	0.59	S	S	.	*			trans	-43.1	143.3	-165.9	0	0	0	0	0	114.9	N195 D199	N195-G197 VanDerWaalsContact C-N 3.28Å; N195-G197 PolarHBondContact O-N 3.43Å; G197-D199 PolarHBondContact O-N 2.89Å
198	I	43.9	Very low	41.2	Very low	33 Å²	33	103.3 Å²	103.3	17%	0.169	57%	0.567	C	S	.	*			trans	-44.9	108.8	174.7	-56.3	170.1	0	0	0	109.5	L194 F203 L328 I331	L194-I198 HydrophobicContact CD2-CG1 4.28Å; I198-F203 HydrophobicContact CG2-CE2 3.62Å; I198-F203 HydrophobicContact CG2-CZ 4.4Å; I198-L328 HydrophobicContact CB-CD2 4.27Å; I198-L328 HydrophobicContact CG2-CD2 3.82Å; I198-I331 HydrophobicContact CD1-CG2 3.81Å
199	D	48.5	Very low	42.8	Very low	92 Å²	92	99.8 Å²	99.8	49%	0.492	55%	0.546	S	S	.	.			trans	-79.9	139.4	179.8	-167	10.3	0	0	0	109.4	G197 S201 Q202	G197-D199 PolarHBondContact O-N 2.89Å; D199-S201 PolarHBondContact O-N 3.2Å; D199-S201 VanDerWaalsContact O-N 3.12Å; D199-S201 PolarHBondContact OD2-OG 3.46Å; D199-Q202 PolarHBondContact O-N 3.21Å; D199-Q202 VanDerWaalsContact O-N 3.15Å
200	K	45.4	Very low	44.4	Very low	96 Å²	96	101.3 Å²	101.3	42%	0.417	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-58.1	-27.8	179.3	-71.4	-179	178	-179.4	0	111.2	Q202 F203 L328	K200-Q202 PolarHBondContact O-N 2.68Å; K200-F203 PolarHBondContact O-N 3.1Å; K200-L328 HydrophobicContact CG-CD1 3.99Å
201	S	53.6	Low	45.7	Very low	90 Å²	90	95.5 Å²	95.5	63%	0.629	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21	-180	62.6	0	0	0	0	114.4	D199 F203	D199-S201 PolarHBondContact O-N 3.2Å; D199-S201 VanDerWaalsContact O-N 3.12Å; D199-S201 PolarHBondContact OD2-OG 3.46Å; S201-F203 PolarHBondContact O-N 3.32Å
202	Q	47.4	Very low	47	Very low	134 Å²	134	88.7 Å²	88.7	63%	0.626	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-73.3	-15.3	179.2	-67.7	-178.5	-7.7	0	0	113.4	D199 K200	D199-Q202 PolarHBondContact O-N 3.21Å; D199-Q202 VanDerWaalsContact O-N 3.15Å; K200-Q202 PolarHBondContact O-N 2.68Å
203	F	48.3	Very low	48.4	Very low	73 Å²	73	88.4 Å²	88.4	32%	0.32	47%	0.467	S	S	.	.	S	Bend	trans	-115.4	127.7	-178.4	-61.4	-84.3	0	0	0	110.1	I198 K200 S201 Y207 W208	I198-F203 HydrophobicContact CG2-CE2 3.62Å; I198-F203 HydrophobicContact CG2-CZ 4.4Å; K200-F203 PolarHBondContact O-N 3.1Å; S201-F203 PolarHBondContact O-N 3.32Å; F203-Y207 HydrophobicContact CB-CD1 4.21Å; F203-Y207 HydrophobicContact CD1-CD1 4.12Å; F203-Y207 HydrophobicContact CD1-CE1 4.14Å; F203-Y207 HydrophobicContact CG-CD1 4.43Å; F203-W208 HydrophobicContact CB-CZ2 4.04Å; F203-W208 AromaticContact CD2-CZ2 3.87Å; F203-W208 HydrophobicContact CD2-CZ2 3.87Å; F203-W208 AromaticContact CG-CZ2 3.99Å; F203-W208 HydrophobicContact CG-CZ2 3.99Å
204	P	51.5	Low	49.5	Very low	90 Å²	90	89.5 Å²	89.5	58%	0.584	46%	0.464	S	S	*	.			trans	-53.9	145	173.2	-24.5	33	0	0	0	111.7	E206 Y207	P204-E206 PolarHBondContact O-N 2.61Å; P204-Y207 VanDerWaalsContact O-CB 3.28Å; P204-Y207 WeakPolarHBondContact O-CB 3.42Å; P204-Y207 PolarHBondContact O-N 3.02Å
205	S	55.7	Low	50.7	Low	84 Å²	84	85.3 Å²	85.3	59%	0.587	44%	0.441	S	S	*	.	H	α-helix	trans	-57.7	-33.1	178.2	60.4	0	0	0	0	112.8	Y207 W208 S209 R320	S205-Y207 VanDerWaalsContact C-N 3.29Å; S205-Y207 PolarHBondContact O-N 3.4Å; S205-W208 PolarHBondContact O-N 2.97Å; S205-S209 PolarHBondContact O-N 2.83Å; S205-S209 VanDerWaalsContact O-N 3.16Å; S205-S209 PolarHBondContact O-OG 2.89Å; S205-R320 PolarHBondContact O-NH2 3.04Å
206	E	55.7	Low	51.6	Low	132 Å²	132	84.2 Å²	84.2	62%	0.617	43%	0.427	S	S	*	.	H	α-helix	trans	-62	-32.8	176	-70.4	-174.9	171.4	0	0	113.3	P204 S209 R210	P204-E206 PolarHBondContact O-N 2.61Å; E206-S209 PolarHBondContact O-N 3.32Å; E206-R210 WeakPolarHBondContact O-CG 3.39Å; E206-R210 PolarHBondContact O-N 3.05Å
207	Y	51.1	Low	52.1	Low	110 Å²	110	84.2 Å²	84.2	43%	0.431	42%	0.421	S	S	.	.	H	α-helix	trans	-60.4	-47.9	177.1	173.9	-96	0	0	0	110.6	F203 P204 S205 R210 L211	F203-Y207 HydrophobicContact CB-CD1 4.21Å; F203-Y207 HydrophobicContact CD1-CD1 4.12Å; F203-Y207 HydrophobicContact CD1-CE1 4.14Å; F203-Y207 HydrophobicContact CG-CD1 4.43Å; P204-Y207 VanDerWaalsContact O-CB 3.28Å; P204-Y207 WeakPolarHBondContact O-CB 3.42Å; P204-Y207 PolarHBondContact O-N 3.02Å; S205-Y207 VanDerWaalsContact C-N 3.29Å; S205-Y207 PolarHBondContact O-N 3.4Å; Y207-R210 PolarHBondContact O-N 3.3Å; Y207-L211 HydrophobicContact CE1-CD1 4.15Å; Y207-L211 WeakPolarHBondContact O-CB 3.31Å; Y207-L211 PolarHBondContact O-N 2.9Å
208	W	57.5	Low	52.7	Low	19 Å²	19	87.1 Å²	87.1	7%	0.072	42%	0.421	C	S	.	.	H	α-helix	trans	-65.2	-40.9	177.3	-60.7	111.5	0	0	0	111.8	F203 S205 R210 L211 E212 V324 L327 L328	F203-W208 HydrophobicContact CB-CZ2 4.04Å; F203-W208 AromaticContact CD2-CZ2 3.87Å; F203-W208 HydrophobicContact CD2-CZ2 3.87Å; F203-W208 AromaticContact CG-CZ2 3.99Å; F203-W208 HydrophobicContact CG-CZ2 3.99Å; S205-W208 PolarHBondContact O-N 2.97Å; W208-R210 PolarHBondContact O-N 3.37Å; W208-L211 PolarHBondContact O-N 2.9Å; W208-E212 WeakPolarHBondContact O-CB 3.36Å; W208-E212 WeakPolarHBondContact O-CG 3.27Å; W208-E212 PolarHBondContact O-N 3.44Å; W208-V324 HydrophobicContact CB-CG2 4.41Å; W208-V324 HydrophobicContact CD2-CG1 3.99Å; W208-V324 HydrophobicContact CD2-CG2 3.92Å; W208-V324 HydrophobicContact CE3-CB 4.43Å; W208-V324 HydrophobicContact CE3-CG1 4.02Å; W208-V324 HydrophobicContact CE3-CG2 3.8Å; W208-V324 HydrophobicContact CG-CG2 4.2Å; W208-V324 HydrophobicContact CH2-CG1 3.95Å; W208-V324 HydrophobicContact CZ2-CG1 3.91Å; W208-V324 HydrophobicContact CZ3-CG1 4.01Å; W208-V324 HydrophobicContact CZ3-CG2 4.42Å; W208-L327 HydrophobicContact CZ3-CD1 4.31Å; W208-L328 HydrophobicContact CH2-CD2 4.18Å; W208-L328 HydrophobicContact CH2-CG 4.29Å; W208-L328 HydrophobicContact CZ2-CD2 4.5Å
209	S	57.7	Low	53.3	Low	54 Å²	54	88.6 Å²	88.6	38%	0.378	43%	0.426	S	S	.	.	H	α-helix	trans	-62	-41.3	176.8	-57.7	0	0	0	0	112.4	S205 E206 S213 R320	S205-S209 PolarHBondContact O-N 2.83Å; S205-S209 VanDerWaalsContact O-N 3.16Å; S205-S209 PolarHBondContact O-OG 2.89Å; E206-S209 PolarHBondContact O-N 3.32Å; S209-S213 WeakPolarHBondContact O-CB 3.45Å; S209-S213 PolarHBondContact O-N 3.47Å; S209-R320 PolarHBondContact OG-NH2 3.01Å
210	R	57	Low	53.8	Low	173 Å²	173	84.7 Å²	84.7	65%	0.653	41%	0.405	S	S	*	.	H	α-helix	trans	-62.4	-48.2	173.6	-76.1	-176.8	-177.6	-178.5	2.8	110.6	E206 Y207 W208 E212 S213 Y214	E206-R210 WeakPolarHBondContact O-CG 3.39Å; E206-R210 PolarHBondContact O-N 3.05Å; Y207-R210 PolarHBondContact O-N 3.3Å; W208-R210 PolarHBondContact O-N 3.37Å; R210-E212 VanDerWaalsContact C-N 3.33Å; R210-E212 PolarHBondContact O-N 3.14Å; R210-S213 WeakPolarHBondContact O-CB 3.44Å; R210-S213 PolarHBondContact O-N 2.79Å; R210-Y214 HydrophobicContact CB-CD2 4.46Å; R210-Y214 HydrophobicContact CB-CE2 4.45Å; R210-Y214 WeakPolarHBondContact O-CD2 2.96Å; R210-Y214 PolarHBondContact O-N 2.92Å
211	L	52.4	Low	54.1	Low	52 Å²	52	85.6 Å²	85.6	27%	0.272	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-40	-178.8	-162.5	146.5	0	0	0	112.1	Y207 W208 Y214 F215 F323 L327	Y207-L211 HydrophobicContact CE1-CD1 4.15Å; Y207-L211 WeakPolarHBondContact O-CB 3.31Å; Y207-L211 PolarHBondContact O-N 2.9Å; W208-L211 PolarHBondContact O-N 2.9Å; L211-Y214 PolarHBondContact O-N 3.03Å; L211-F215 WeakPolarHBondContact O-CB 3.21Å; L211-F215 PolarHBondContact O-N 3.16Å; L211-F323 HydrophobicContact CD2-CE1 3.75Å; L211-F323 HydrophobicContact CD2-CZ 3.85Å; L211-L327 HydrophobicContact CD2-CD1 3.53Å
212	E	56.2	Low	53.8	Low	35 Å²	35	88.5 Å²	88.5	16%	0.164	42%	0.418	C	S	.	.	H	α-helix	trans	-61.8	-47.6	171.8	-77.8	166	-139	0	0	112.2	W208 R210 Y214 F215 Y216 F316 R320 F323	W208-E212 WeakPolarHBondContact O-CB 3.36Å; W208-E212 WeakPolarHBondContact O-CG 3.27Å; W208-E212 PolarHBondContact O-N 3.44Å; R210-E212 VanDerWaalsContact C-N 3.33Å; R210-E212 PolarHBondContact O-N 3.14Å; E212-Y214 VanDerWaalsContact C-N 3.31Å; E212-Y214 PolarHBondContact O-N 2.83Å; E212-F215 PolarHBondContact O-N 3.06Å; E212-Y216 WeakPolarHBondContact O-CB 3.41Å; E212-Y216 PolarHBondContact O-N 2.88Å; E212-F316 HydrophobicContact CB-CE2 4.18Å; E212-F316 HydrophobicContact CG-CE2 4.19Å; E212-R320 WeakPolarHBondContact OE1-CD 3.47Å; E212-R320 WeakPolarHBondContact OE1-CG 3.44Å; E212-R320 IonicContact OE1-CZ 3.42Å; E212-R320 IonicContact OE1-NE 2.73Å; E212-R320 PolarHBondContact OE1-NE 3.34Å; E212-R320 IonicContact OE1-NH2 2.78Å; E212-R320 IonicContact OE2-NE 3.14Å; E212-R320 PolarHBondContact OE2-NE 3.5Å; E212-F323 HydrophobicContact CG-CD1 3.82Å; E212-F323 HydrophobicContact CG-CE1 3.75Å
213	S	57.3	Low	53.9	Low	54 Å²	54	83 Å²	83	38%	0.378	39%	0.391	S	S	.	.	H	α-helix	trans	-59.9	-42.5	177.4	-170.6	0	0	0	0	111.6	S209 R210 K217	S209-S213 WeakPolarHBondContact O-CB 3.45Å; S209-S213 PolarHBondContact O-N 3.47Å; R210-S213 WeakPolarHBondContact O-CB 3.44Å; R210-S213 PolarHBondContact O-N 2.79Å; S213-K217 WeakPolarHBondContact O-CB 3.16Å; S213-K217 VanDerWaalsContact O-CG 3.31Å; S213-K217 WeakPolarHBondContact O-CG 3.43Å; S213-K217 PolarHBondContact O-N 3.03Å
214	Y	51.8	Low	53.7	Low	132 Å²	132	83 Å²	83	52%	0.518	40%	0.398	S	S	.	.	H	α-helix	trans	-63.7	-46.5	174.5	-82.3	-66.8	0	0	0	112	R210 L211 E212 Y216 K217 R218	R210-Y214 HydrophobicContact CB-CD2 4.46Å; R210-Y214 HydrophobicContact CB-CE2 4.45Å; R210-Y214 WeakPolarHBondContact O-CD2 2.96Å; R210-Y214 PolarHBondContact O-N 2.92Å; L211-Y214 PolarHBondContact O-N 3.03Å; E212-Y214 VanDerWaalsContact C-N 3.31Å; E212-Y214 PolarHBondContact O-N 2.83Å; Y214-Y216 PolarHBondContact O-N 3.48Å; Y214-K217 PolarHBondContact O-N 2.92Å; Y214-R218 VanDerWaalsContact O-CB 3.23Å; Y214-R218 WeakPolarHBondContact O-CB 3.48Å; Y214-R218 PolarHBondContact O-N 3.5Å
215	F	58.2	Low	53.4	Low	25 Å²	25	82.3 Å²	82.3	11%	0.11	39%	0.387	C	S	.	.	H	α-helix	trans	-60.8	-45.9	178.6	-172.7	-94.4	0	0	0	111.4	L211 E212 R218 F219 V312 I313 F316 F323	L211-F215 WeakPolarHBondContact O-CB 3.21Å; L211-F215 PolarHBondContact O-N 3.16Å; E212-F215 PolarHBondContact O-N 3.06Å; F215-R218 PolarHBondContact O-N 3.3Å; F215-F219 AromaticContact CD2-CD2 3.44Å; F215-F219 HydrophobicContact CD2-CD2 3.44Å; F215-F219 VanDerWaalsContact CD2-CD2 3.44Å; F215-F219 AromaticContact CD2-CE2 3.84Å; F215-F219 HydrophobicContact CD2-CE2 3.84Å; F215-F219 HydrophobicContact CD2-CG 4.31Å; F215-F219 HydrophobicContact CE1-CB 4.44Å; F215-F219 HydrophobicContact CE2-CB 4.42Å; F215-F219 AromaticContact CE2-CD2 3.54Å; F215-F219 HydrophobicContact CE2-CD2 3.54Å; F215-F219 AromaticContact CE2-CE2 3.95Å; F215-F219 HydrophobicContact CE2-CE2 3.95Å; F215-F219 HydrophobicContact CE2-CG 4.03Å; F215-F219 HydrophobicContact CG-CD2 4.07Å; F215-F219 HydrophobicContact CZ-CB 4.29Å; F215-F219 HydrophobicContact CZ-CD2 4.24Å; F215-F219 HydrophobicContact CZ-CG 4.34Å; F215-F219 WeakPolarHBondContact O-CB 3.37Å; F215-F219 PolarHBondContact O-N 3.48Å; F215-V312 HydrophobicContact CD2-CG1 4.46Å; F215-V312 HydrophobicContact CE2-CG1 3.65Å; F215-V312 HydrophobicContact CZ-CG1 3.78Å; F215-I313 HydrophobicContact CZ-CG1 3.84Å; F215-F316 HydrophobicContact CD1-CB 4.29Å; F215-F316 HydrophobicContact CD1-CD1 4.48Å; F215-F316 AromaticContact CD1-CD2 3.5Å; F215-F316 HydrophobicContact CD1-CD2 3.5Å; F215-F316 AromaticContact CD1-CE2 3.89Å; F215-F316 HydrophobicContact CD1-CE2 3.89Å; F215-F316 AromaticContact CD1-CG 3.83Å; F215-F316 HydrophobicContact CD1-CG 3.83Å; F215-F316 HydrophobicContact CE1-CB 3.87Å; F215-F316 AromaticContact CE1-CD2 3.99Å; F215-F316 HydrophobicContact CE1-CD2 3.99Å; F215-F316 AromaticContact CE1-CG 3.87Å; F215-F316 HydrophobicContact CE1-CG 3.87Å; F215-F316 HydrophobicContact CG-CD2 4.4Å; F215-F323 HydrophobicContact CB-CZ 4.04Å; F215-F323 HydrophobicContact CD1-CE2 4.06Å; F215-F323 HydrophobicContact CD1-CZ 4.2Å; F215-F323 HydrophobicContact CD2-CE2 4.23Å; F215-F323 HydrophobicContact CD2-CZ 4.19Å; F215-F323 HydrophobicContact CE1-CE2 4.22Å; F215-F323 HydrophobicContact CE2-CE2 4.39Å; F215-F323 HydrophobicContact CG-CE2 4.06Å; F215-F323 AromaticContact CG-CZ 3.87Å; F215-F323 HydrophobicContact CG-CZ 3.87Å; F215-F323 HydrophobicContact CZ-CE2 4.38Å
216	Y	55.1	Low	52.3	Low	120 Å²	120	81.2 Å²	81.2	47%	0.471	38%	0.379	S	S	.	.	I	π-helix	trans	-60.4	-53.6	177.1	-178.5	-95.7	0	0	0	112.1	E212 Y214 R218 L220 L221 F316	E212-Y216 WeakPolarHBondContact O-CB 3.41Å; E212-Y216 PolarHBondContact O-N 2.88Å; Y214-Y216 PolarHBondContact O-N 3.48Å; Y216-R218 VanDerWaalsContact C-N 3.25Å; Y216-R218 PolarHBondContact O-N 3.32Å; Y216-L220 HydrophobicContact CD2-CB 4.03Å; Y216-L220 HydrophobicContact CD2-CD1 3.72Å; Y216-L220 HydrophobicContact CD2-CG 4.46Å; Y216-L220 HydrophobicContact CE2-CB 4.3Å; Y216-L220 HydrophobicContact CE2-CD1 4.35Å; Y216-L220 WeakPolarHBondContact O-CB 3.26Å; Y216-L220 PolarHBondContact O-N 2.95Å; Y216-L221 HydrophobicContact CD1-CD1 4.26Å; Y216-L221 HydrophobicContact CE1-CD1 3.7Å; Y216-L221 PolarHBondContact O-N 3.13Å; Y216-F316 HydrophobicContact CD2-CE1 4.06Å; Y216-F316 HydrophobicContact CD2-CZ 4.17Å
217	K	50.6	Low	51.2	Low	135 Å²	135	80.8 Å²	80.8	59%	0.587	38%	0.377	S	S	*	.	I	π-helix	trans	-58.4	-37.9	179.7	-75.7	178.9	-177.5	179.7	0	112.1	S213 Y214 L221	S213-K217 WeakPolarHBondContact O-CB 3.16Å; S213-K217 VanDerWaalsContact O-CG 3.31Å; S213-K217 WeakPolarHBondContact O-CG 3.43Å; S213-K217 PolarHBondContact O-N 3.03Å; Y214-K217 PolarHBondContact O-N 2.92Å; K217-L221 WeakPolarHBondContact O-CB 3.39Å
218	R	52.5	Low	50	Low	96 Å²	96	79.5 Å²	79.5	36%	0.362	38%	0.377	S	S	.	.	I	π-helix	trans	-83.6	-48.3	-174.2	-170.7	68.2	176.7	128.7	-6	113.6	Y214 F215 Y216 P994	Y214-R218 VanDerWaalsContact O-CB 3.23Å; Y214-R218 WeakPolarHBondContact O-CB 3.48Å; Y214-R218 PolarHBondContact O-N 3.5Å; F215-R218 PolarHBondContact O-N 3.3Å; Y216-R218 VanDerWaalsContact C-N 3.25Å; Y216-R218 PolarHBondContact O-N 3.32Å; R218-P994 PolarHBondContact NH2-O 2.94Å
219	F	56	Low	48.6	Very low	64 Å²	64	82.9 Å²	82.9	28%	0.281	40%	0.396	S	S	.	.	I	π-helix	trans	-100.2	-27.7	-168.3	-69.8	-80.3	0	0	0	113.5	F215 R223 W293	F215-F219 AromaticContact CD2-CD2 3.44Å; F215-F219 HydrophobicContact CD2-CD2 3.44Å; F215-F219 VanDerWaalsContact CD2-CD2 3.44Å; F215-F219 AromaticContact CD2-CE2 3.84Å; F215-F219 HydrophobicContact CD2-CE2 3.84Å; F215-F219 HydrophobicContact CD2-CG 4.31Å; F215-F219 HydrophobicContact CE1-CB 4.44Å; F215-F219 HydrophobicContact CE2-CB 4.42Å; F215-F219 AromaticContact CE2-CD2 3.54Å; F215-F219 HydrophobicContact CE2-CD2 3.54Å; F215-F219 AromaticContact CE2-CE2 3.95Å; F215-F219 HydrophobicContact CE2-CE2 3.95Å; F215-F219 HydrophobicContact CE2-CG 4.03Å; F215-F219 HydrophobicContact CG-CD2 4.07Å; F215-F219 HydrophobicContact CZ-CB 4.29Å; F215-F219 HydrophobicContact CZ-CD2 4.24Å; F215-F219 HydrophobicContact CZ-CG 4.34Å; F215-F219 WeakPolarHBondContact O-CB 3.37Å; F215-F219 PolarHBondContact O-N 3.48Å; F219-R223 WeakPolarHBondContact O-CD 3.31Å; F219-R223 VanDerWaalsContact O-CG 3.31Å; F219-R223 WeakPolarHBondContact O-CG 3.33Å; F219-W293 HydrophobicContact CD1-CH2 4.41Å
220	L	58.3	Low	47	Very low	11 Å²	11	85.1 Å²	85.1	6%	0.058	41%	0.407	C	S	.	.	I	π-helix	trans	-103.1	-38.8	-172.8	-59.1	-178.8	0	0	0	112.2	Y216 E222 R223 F316 Y317	Y216-L220 HydrophobicContact CD2-CB 4.03Å; Y216-L220 HydrophobicContact CD2-CD1 3.72Å; Y216-L220 HydrophobicContact CD2-CG 4.46Å; Y216-L220 HydrophobicContact CE2-CB 4.3Å; Y216-L220 HydrophobicContact CE2-CD1 4.35Å; Y216-L220 WeakPolarHBondContact O-CB 3.26Å; Y216-L220 PolarHBondContact O-N 2.95Å; L220-E222 PolarHBondContact O-N 2.78Å; L220-R223 PolarHBondContact O-N 3.35Å; L220-F316 HydrophobicContact CD1-CD1 3.36Å; L220-F316 HydrophobicContact CD1-CE1 3.25Å; L220-F316 HydrophobicContact CD1-CG 4.29Å; L220-F316 HydrophobicContact CD1-CZ 4.12Å; L220-Y317 HydrophobicContact CD1-CE1 4.36Å; L220-Y317 HydrophobicContact CD2-CE1 4.46Å; L220-Y317 HydrophobicContact CD2-CE2 4.12Å; L220-Y317 WeakPolarHBondContact CD2-OH 3.03Å
221	L	51.4	Low	45.5	Very low	114 Å²	114	83.9 Å²	83.9	60%	0.597	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-35.2	-175.4	-151.5	122.6	0	0	0	113.5	Y216 K217 R223	Y216-L221 HydrophobicContact CD1-CD1 4.26Å; Y216-L221 HydrophobicContact CE1-CD1 3.7Å; Y216-L221 PolarHBondContact O-N 3.13Å; K217-L221 WeakPolarHBondContact O-CB 3.39Å; L221-R223 VanDerWaalsContact C-N 3.33Å
222	E	48.3	Very low	44.2	Very low	152 Å²	152	89.6 Å²	89.6	71%	0.71	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	5.1	178.5	-65.4	-149.6	172.3	0	0	114.2	L220	L220-E222 PolarHBondContact O-N 2.78Å
223	R	50.4	Low	42.9	Very low	17 Å²	17	91.7 Å²	91.7	6%	0.064	45%	0.454	C	S	.	.			trans	-78.2	127.1	179.4	-92.1	-179.9	156.4	-156.9	-5.7	111.1	F219 L220 L221 F225 E285 W293	F219-R223 WeakPolarHBondContact O-CD 3.31Å; F219-R223 VanDerWaalsContact O-CG 3.31Å; F219-R223 WeakPolarHBondContact O-CG 3.33Å; L220-R223 PolarHBondContact O-N 3.35Å; L221-R223 VanDerWaalsContact C-N 3.33Å; R223-F225 HydrophobicContact CB-CD2 3.87Å; R223-F225 HydrophobicContact CB-CE1 4.25Å; R223-F225 HydrophobicContact CB-CE2 3.3Å; R223-F225 HydrophobicContact CB-CZ 3.54Å; R223-F225 VanDerWaalsContact CD-CZ 3.41Å; R223-F225 HydrophobicContact CG-CE2 4.31Å; R223-F225 HydrophobicContact CG-CZ 4.12Å; R223-F225 WeakPolarHBondContact O-CD2 3.43Å; R223-F225 PolarHBondContact O-N 2.6Å; R223-E285 IonicContact CZ-OE2 3.8Å; R223-E285 IonicContact NH1-OE1 3.46Å; R223-E285 PolarHBondContact NH1-OE1 3.41Å; R223-E285 IonicContact NH1-OE2 2.75Å; R223-E285 PolarHBondContact NH1-OE2 3.21Å; R223-W293 HydrophobicContact CG-CD2 4.45Å; R223-W293 HydrophobicContact CG-CH2 4.5Å; R223-W293 HydrophobicContact CG-CZ2 3.71Å; R223-W293 VanDerWaalsContact NH2-CZ3 3.34Å
224	P	43.3	Very low	41.8	Very low	73 Å²	73	95.1 Å²	95.1	47%	0.474	48%	0.478	S	S	.	.			trans	-76.1	90.8	176.6	29.6	-31.2	0	0	0	109.4
225	F	45.8	Very low	40.7	Very low	77 Å²	77	96.6 Å²	96.6	34%	0.338	49%	0.49	S	S	.	.			trans	-91.2	126.7	174.3	-64.6	-67.9	0	0	0	111.8	R223 H227 E285 Y317	R223-F225 HydrophobicContact CB-CD2 3.87Å; R223-F225 HydrophobicContact CB-CE1 4.25Å; R223-F225 HydrophobicContact CB-CE2 3.3Å; R223-F225 HydrophobicContact CB-CZ 3.54Å; R223-F225 VanDerWaalsContact CD-CZ 3.41Å; R223-F225 HydrophobicContact CG-CE2 4.31Å; R223-F225 HydrophobicContact CG-CZ 4.12Å; R223-F225 WeakPolarHBondContact O-CD2 3.43Å; R223-F225 PolarHBondContact O-N 2.6Å; F225-H227 PolarHBondContact O-N 2.91Å; F225-H227 PolarHBondContact O-ND1 3.29Å; F225-E285 HydrophobicContact CE1-CG 4.05Å; F225-E285 WeakPolarHBondContact CE1-OE1 3.47Å; F225-E285 WeakPolarHBondContact CZ-OE1 3.44Å; F225-Y317 WeakPolarHBondContact CZ-OH 3.46Å
226	S	32.8	Very low	39.3	Very low	61 Å²	61	98 Å²	98	43%	0.427	51%	0.512	S	S	.	.			trans	-68.6	116.4	152.8	47.8	0	0	0	0	107.6	N228	S226-N228 VanDerWaalsContact C-N 3.31Å; S226-N228 PolarHBondContact O-N 3.42Å
227	H	31.5	Very low	38	Very low	123 Å²	123	100.8 Å²	100.8	57%	0.569	53%	0.534	S	S	*	.			trans	-70	89.4	177.5	-69.1	50.7	0	0	0	108.5	F225 I229 M244	F225-H227 PolarHBondContact O-N 2.91Å; F225-H227 PolarHBondContact O-ND1 3.29Å; H227-I229 HydrophobicContact CB-CG1 4.47Å; H227-I229 PolarHBondContact O-N 2.96Å; H227-M244 HydrophobicContact CB-CE 4.3Å
228	N	26.1	Very low	36.7	Very low	82 Å²	82	103.2 Å²	103.2	44%	0.439	55%	0.545	S	S	.	.			trans	-77.3	83.6	168.3	-72.9	-19.4	0	0	0	107.5	S226 V230	S226-N228 VanDerWaalsContact C-N 3.31Å; S226-N228 PolarHBondContact O-N 3.42Å; N228-V230 PolarHBondContact O-N 3.5Å; N228-V230 VanDerWaalsContact O-N 3.09Å
229	I	27.1	Very low	35.4	Very low	91 Å²	91	110 Å²	110	47%	0.467	57%	0.571	S	S	.	*			trans	-70.5	103	169	-57.4	174.1	0	0	0	106.4	H227 M231 I258	H227-I229 HydrophobicContact CB-CG1 4.47Å; H227-I229 PolarHBondContact O-N 2.96Å; I229-M231 HydrophobicContact CG2-CE 4.22Å; I229-M231 HydrophobicContact CG2-CG 3.95Å; I229-M231 PolarHBondContact O-N 3.33Å; I229-I258 HydrophobicContact CD1-CD1 4.04Å
230	V	24.9	Very low	34	Very low	101 Å²	101	113.1 Å²	113.1	61%	0.612	60%	0.595	S	S	*	*			trans	-87.8	99.5	172.5	-179.4	0	0	0	0	107.1	N228 Q232	N228-V230 PolarHBondContact O-N 3.5Å; N228-V230 VanDerWaalsContact O-N 3.09Å; V230-Q232 PolarHBondContact O-N 3.13Å
231	M	25.7	Very low	32.4	Very low	146 Å²	146	118.1 Å²	118.1	72%	0.719	63%	0.626	S	S	*	*			trans	-83.5	111.5	168.9	-69.8	-166.4	165.2	0	0	108.8	I229 S233	I229-M231 HydrophobicContact CG2-CE 4.22Å; I229-M231 HydrophobicContact CG2-CG 3.95Å; I229-M231 PolarHBondContact O-N 3.33Å; M231-S233 PolarHBondContact O-N 3.03Å
232	Q	24.5	Very low	31.1	Very low	173 Å²	173	116.4 Å²	116.4	81%	0.808	63%	0.629	S	S	*	*			trans	-82.1	100.7	174.7	-165.9	172.2	2.4	0	0	107.8	V230 S234	V230-Q232 PolarHBondContact O-N 3.13Å; Q232-S234 PolarHBondContact O-N 3.42Å
233	S	30.2	Very low	29.9	Very low	79 Å²	79	115 Å²	115	55%	0.552	63%	0.631	S	S	*	*			trans	-63.3	127.7	163.3	171.4	0	0	0	0	108	M231 E235	M231-S233 PolarHBondContact O-N 3.03Å; S233-E235 PolarHBondContact O-N 3.36Å; S233-E235 PolarHBondContact OG-N 3.44Å; S233-E235 VanDerWaalsContact OG-N 3.07Å; S233-E235 PolarHBondContact OG-O 2.58Å
234	S	33.1	Very low	28.6	Very low	125 Å²	125	118.8 Å²	118.8	87%	0.874	65%	0.65	S	S	*	*	S	Bend	trans	-67.1	-12.2	170.9	45.7	0	0	0	0	112.2	Q232 G236	Q232-S234 PolarHBondContact O-N 3.42Å; S234-G236 PolarHBondContact O-N 3.19Å
235	E	28.7	Very low	27.6	Very low	163 Å²	163	120 Å²	120	76%	0.762	67%	0.666	S	S	*	*	S	Bend	trans	-94.5	95.4	176.8	-64.2	-173.6	170	0	0	111.2	S233	S233-E235 PolarHBondContact O-N 3.36Å; S233-E235 PolarHBondContact OG-N 3.44Å; S233-E235 VanDerWaalsContact OG-N 3.07Å; S233-E235 PolarHBondContact OG-O 2.58Å
236	G	28.4	Very low	26.5	Very low	56 Å²	56	121.2 Å²	121.2	58%	0.577	68%	0.683	S	S	*	*	S	Bend	trans	65.1	88.3	150.4	0	0	0	0	0	117.9	S234 K238	S234-G236 PolarHBondContact O-N 3.19Å; G236-K238 PolarHBondContact O-N 3.46Å
237	N	28.7	Very low	26	Very low	177 Å²	177	123.6 Å²	123.6	95%	0.947	70%	0.697	S	S	*	*	S	Bend	trans	44.9	6	147.8	-81.1	-13.2	0	0	0	121.4
238	K	24.1	Very low	25.6	Very low	187 Å²	187	125 Å²	125	81%	0.813	71%	0.707	S	S	*	*			trans	-99.8	94.1	177.5	-70	-174.9	-179.8	177.6	0	109.6	G236 T240	G236-K238 PolarHBondContact O-N 3.46Å; K238-T240 PolarHBondContact O-N 3.22Å
239	R	23.5	Very low	25.6	Very low	238 Å²	238	130.5 Å²	130.5	90%	0.898	73%	0.727	S	S	*	*			trans	-68.3	106.8	168.8	-80.8	179.1	170.3	171.4	-3.3	109.6
240	T	28.1	Very low	25.5	Very low	130 Å²	130	132.3 Å²	132.3	80%	0.798	75%	0.748	S	S	*	*			trans	-94.5	98.7	163.2	33.2	0	0	0	0	109.4	K238 A242	K238-T240 PolarHBondContact O-N 3.22Å; T240-A242 PolarHBondContact O-N 3Å
241	T	23.4	Very low	25.6	Very low	115 Å²	115	132.3 Å²	132.3	71%	0.706	75%	0.753	S	S	*	*			trans	-81.4	106.8	169.2	48.4	0	0	0	0	108.8
242	A	25.6	Very low	25.6	Very low	79 Å²	79	128.6 Å²	128.6	65%	0.653	75%	0.752	S	S	*	*			trans	-87.7	110.4	169.3	0	0	0	0	0	109.1	T240 M244	T240-A242 PolarHBondContact O-N 3Å; A242-M244 PolarHBondContact O-N 3.4Å
243	T	22.7	Very low	25.5	Very low	123 Å²	123	130 Å²	130	76%	0.755	76%	0.756	S	S	*	*			trans	-81.4	106.4	172.9	44.5	0	0	0	0	109.4	A245	T243-A245 PolarHBondContact O-N 2.93Å
244	M	22.5	Very low	25.1	Very low	96 Å²	96	137.7 Å²	137.7	47%	0.473	77%	0.773	S	S	.	*			trans	-73.9	119	169.1	-67.7	-144.9	-58.2	0	0	109.7	H227 A242	H227-M244 HydrophobicContact CB-CE 4.3Å; A242-M244 PolarHBondContact O-N 3.4Å
245	A	22.1	Very low	24.5	Very low	97 Å²	97	137.6 Å²	137.6	80%	0.802	77%	0.771	S	S	*	*			trans	-83.3	133.1	-178.3	0	0	0	0	0	112	T243	T243-A245 PolarHBondContact O-N 2.93Å
246	C	22.4	Very low	24.2	Very low	103 Å²	103	135.8 Å²	135.8	70%	0.696	77%	0.77	S	S	*	*			trans	80	119.6	155.6	-147.7	0	0	0	0	119.1
247	P	23.1	Very low	23.7	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	78%	0.779	S	S	*	*			trans	-81.7	122.1	171.3	32.6	-29.1	0	0	0	109.7
248	I	23.6	Very low	23.5	Very low	153 Å²	153	133.7 Å²	133.7	79%	0.785	76%	0.762	S	S	*	*			trans	-118.1	126.9	170.9	-57.4	178.4	0	0	0	108.3	S250	I248-S250 PolarHBondContact O-N 3.34Å
249	K	25.2	Very low	23.3	Very low	198 Å²	198	132.4 Å²	132.4	86%	0.861	76%	0.764	S	S	*	*			trans	-47.5	128.8	-178.9	-71.2	174.7	174.4	178.5	0	111	S251	K249-S251 PolarHBondContact O-N 3.23Å
250	S	26.3	Very low	23.3	Very low	128 Å²	128	125.7 Å²	125.7	90%	0.895	75%	0.749	S	S	*	*			trans	-70	84.5	-176.7	54.8	0	0	0	0	111.9	I248	I248-S250 PolarHBondContact O-N 3.34Å
251	S	26.8	Very low	23	Very low	102 Å²	102	124.7 Å²	124.7	71%	0.713	75%	0.746	S	S	*	*	S	Bend	trans	-133.9	93.3	156.4	61.3	0	0	0	0	108.3	K249	K249-S251 PolarHBondContact O-N 3.23Å
252	G	24.7	Very low	22.9	Very low	68 Å²	68	125 Å²	125	70%	0.701	75%	0.751	S	S	*	*	S	Bend	trans	113.4	-3.6	148.1	0	0	0	0	0	120.6
253	F	22	Very low	22.8	Very low	203 Å²	203	126.2 Å²	126.2	89%	0.89	75%	0.754	S	S	*	*			trans	-134.8	116.2	-177.6	-68.5	-80.5	0	0	0	114.4
254	R	22.5	Very low	22.8	Very low	240 Å²	240	128.1 Å²	128.1	91%	0.906	76%	0.758	S	S	*	*			trans	-60	158.5	155.5	-85.2	178.3	170.5	167	-3	109.4
255	C	20.7	Very low	22.7	Very low	123 Å²	123	132.7 Å²	132.7	83%	0.831	78%	0.778	S	S	*	*			trans	109.3	104.4	162.5	-50.4	0	0	0	0	114.8
256	V	22	Very low	22.6	Very low	125 Å²	125	136.8 Å²	136.8	76%	0.758	78%	0.781	S	S	*	*			trans	-139.6	110	143.4	-174.7	0	0	0	0	107
257	G	18.6	Very low	22.5	Very low	74 Å²	74	138.6 Å²	138.6	76%	0.763	79%	0.788	S	S	*	*			trans	-71.2	143.2	175.5	0	0	0	0	0	111.2
258	I	24	Very low	22.4	Very low	115 Å²	115	136.7 Å²	136.7	59%	0.59	79%	0.789	S	S	*	*			trans	-103.8	117.4	164.3	-55.8	177.8	0	0	0	106.4	I229 V260	I229-I258 HydrophobicContact CD1-CD1 4.04Å; I258-V260 VanDerWaalsContact C-N 3.31Å; I258-V260 HydrophobicContact CB-CG2 4.29Å; I258-V260 HydrophobicContact CG2-CG2 3.55Å; I258-V260 PolarHBondContact O-N 3.49Å
259	N	20.5	Very low	22.2	Very low	160 Å²	160	135.9 Å²	135.9	86%	0.856	79%	0.79	S	S	*	*			trans	-71.9	87.9	172	-168	24.9	0	0	0	108.1
260	V	23.5	Very low	22	Very low	97 Å²	97	134.6 Å²	134.6	59%	0.588	79%	0.792	S	S	*	*			trans	-102.2	113.6	169	-170.3	0	0	0	0	106.8	I258	I258-V260 VanDerWaalsContact C-N 3.31Å; I258-V260 HydrophobicContact CB-CG2 4.29Å; I258-V260 HydrophobicContact CG2-CG2 3.55Å; I258-V260 PolarHBondContact O-N 3.49Å
261	C	21.2	Very low	21.9	Very low	108 Å²	108	132.5 Å²	132.5	73%	0.73	78%	0.777	S	S	*	*			trans	-54.6	129.2	172.1	-97.8	0	0	0	0	109.4	S263	C261-S263 PolarHBondContact O-N 2.75Å
262	P	21.3	Very low	21.7	Very low	123 Å²	123	133.2 Å²	133.2	80%	0.799	78%	0.782	S	S	*	*			trans	-82.8	107.9	-173.1	31.9	-31.2	0	0	0	109.2
263	S	22.5	Very low	21.6	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	78%	0.781	S	S	*	*			trans	-150.1	122.4	160.9	-65.8	0	0	0	0	106.1	C261	C261-S263 PolarHBondContact O-N 2.75Å
264	I	22.5	Very low	21.8	Very low	163 Å²	163	134.9 Å²	134.9	84%	0.836	78%	0.777	S	S	*	*			trans	99.1	110.6	-179.1	-45.2	153.1	0	0	0	113.4	E266	I264-E266 PolarHBondContact O-N 2.93Å
265	Q	20.9	Very low	22.1	Very low	191 Å²	191	131.7 Å²	131.7	89%	0.893	77%	0.772	S	S	*	*			trans	-76.2	98	174.5	-65.8	166.2	-33.5	0	0	108.7
266	E	20.1	Very low	22.3	Very low	184 Å²	184	129.4 Å²	129.4	86%	0.86	75%	0.754	S	S	*	*			trans	-154.4	111.8	158	-111.8	165.1	-146.3	0	0	109.5	I264 G268	I264-E266 PolarHBondContact O-N 2.93Å; E266-G268 PolarHBondContact O-N 3.47Å
267	V	20	Very low	22.5	Very low	141 Å²	141	132.4 Å²	132.4	86%	0.855	75%	0.752	S	S	*	*			trans	-79.9	101	-174.5	178.1	0	0	0	0	108.3	V269	V267-V269 PolarHBondContact O-N 3.31Å
268	G	21.2	Very low	22.7	Very low	71 Å²	71	135.8 Å²	135.8	73%	0.732	75%	0.748	S	S	*	*			trans	-71.2	121.3	171.6	0	0	0	0	0	111.4	E266	E266-G268 PolarHBondContact O-N 3.47Å
269	V	20.4	Very low	22.7	Very low	135 Å²	135	139.7 Å²	139.7	82%	0.818	76%	0.761	S	S	*	*			trans	-71.5	129.7	-179.3	178.7	0	0	0	0	110.8	V267 C271	V267-V269 PolarHBondContact O-N 3.31Å; V269-C271 PolarHBondContact O-N 3.31Å
270	L	21.2	Very low	22.8	Very low	171 Å²	171	136 Å²	136	90%	0.895	76%	0.76	S	S	*	*			trans	-66	106	170.4	-83.7	149.1	0	0	0	110.2
271	C	23.7	Very low	23	Very low	85 Å²	85	135.6 Å²	135.6	57%	0.574	76%	0.761	S	S	*	*			trans	-79.7	120.6	168.9	-167.8	0	0	0	0	109.9	V269 R273 T276	V269-C271 PolarHBondContact O-N 3.31Å; C271-R273 VanDerWaalsContact C-N 3.26Å; C271-R273 PolarHBondContact O-N 3.5Å; C271-T276 PolarHBondContact SG-OG1 2.89Å
272	S	23	Very low	23.2	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	76%	0.761	S	S	*	*			trans	-85.4	11.5	179	56.4	0	0	0	0	113.6
273	R	23	Very low	23.8	Very low	182 Å²	182	139.5 Å²	139.5	69%	0.687	76%	0.759	S	S	*	*			trans	-132.1	130.1	-176.7	-65.4	-175.1	178.6	166.1	-0.3	112.1	C271 E275	C271-R273 VanDerWaalsContact C-N 3.26Å; C271-R273 PolarHBondContact O-N 3.5Å; R273-E275 PolarHBondContact O-N 3.29Å
274	P	25.6	Very low	24.5	Very low	123 Å²	123	143.6 Å²	143.6	80%	0.799	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-0.2	179	30.3	-34	0	0	0	114.3	T276	P274-T276 VanDerWaalsContact C-N 3.29Å; P274-T276 PolarHBondContact O-N 3.05Å
275	E	28.6	Very low	25.6	Very low	173 Å²	173	138 Å²	138	81%	0.808	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-7.8	-173.8	-67.2	-179	174.6	0	0	113.9	R273	R273-E275 PolarHBondContact O-N 3.29Å
276	T	25.1	Very low	27.3	Very low	75 Å²	75	131.5 Å²	131.5	46%	0.46	70%	0.704	S	S	.	*			trans	-108	98.2	174.5	52.3	0	0	0	0	109	C271 P274 E278	C271-T276 PolarHBondContact SG-OG1 2.89Å; P274-T276 VanDerWaalsContact C-N 3.29Å; P274-T276 PolarHBondContact O-N 3.05Å; T276-E278 PolarHBondContact O-N 3.16Å
277	R	26.1	Very low	29.2	Very low	189 Å²	189	127.6 Å²	127.6	71%	0.713	69%	0.686	S	S	*	*			trans	-71.9	46.9	172.7	-71	-177.5	171.3	-153.3	-6.5	111.1
278	E	22.9	Very low	31.2	Very low	145 Å²	145	124.8 Å²	124.8	68%	0.678	67%	0.673	S	S	*	*			trans	-113.5	127.3	-177.3	-63.4	-176.4	177.4	0	0	107.6	T276	T276-E278 PolarHBondContact O-N 3.16Å
279	F	22.8	Very low	33	Very low	197 Å²	197	125 Å²	125	86%	0.864	66%	0.656	S	S	*	*	S	Bend	trans	89.9	90.8	-178	-59.3	-83.9	0	0	0	118.2	C281	F279-C281 VanDerWaalsContact C-N 3.34Å; F279-C281 PolarHBondContact O-N 3.22Å
280	G	23.4	Very low	35	Very low	81 Å²	81	118.9 Å²	118.9	84%	0.835	62%	0.618	S	S	*	*				74.5	-9.8	108.9	0	0	0	0	0	120.8	L282	G280-L282 PolarHBondContact O-N 3.29Å
281	C	27.5	Very low	37.2	Very low	89 Å²	89	115.4 Å²	115.4	60%	0.601	60%	0.596	S	S	*	*			trans	-88.5	90	171.4	-71.6	0	0	0	0	109.7	F279 F283	F279-C281 VanDerWaalsContact C-N 3.34Å; F279-C281 PolarHBondContact O-N 3.22Å; C281-F283 VanDerWaalsContact C-N 3.35Å; C281-F283 HydrophobicContact CB-CD2 4.46Å; C281-F283 HydrophobicContact CB-CE2 4Å; C281-F283 HydrophobicContact CB-CZ 4.41Å; C281-F283 WeakPolarHBondContact O-CD2 3.44Å; C281-F283 PolarHBondContact O-N 3.06Å
282	L	25.8	Very low	39.3	Very low	140 Å²	140	117.8 Å²	117.8	73%	0.733	60%	0.598	S	S	*	*			trans	-69.2	92.8	169.5	-89.2	155.1	0	0	0	109.2	G280 Y284	G280-L282 PolarHBondContact O-N 3.29Å; L282-Y284 PolarHBondContact O-N 2.94Å
283	F	33.8	Very low	41.5	Very low	173 Å²	173	114 Å²	114	76%	0.759	57%	0.566	S	S	*	*			trans	-64.8	99.7	166.9	-65	-88.7	0	0	0	108.7	C281 E285	C281-F283 VanDerWaalsContact C-N 3.35Å; C281-F283 HydrophobicContact CB-CD2 4.46Å; C281-F283 HydrophobicContact CB-CE2 4Å; C281-F283 HydrophobicContact CB-CZ 4.41Å; C281-F283 WeakPolarHBondContact O-CD2 3.44Å; C281-F283 PolarHBondContact O-N 3.06Å; F283-E285 PolarHBondContact O-N 3.08Å
284	Y	37.5	Very low	43.6	Very low	191 Å²	191	105.4 Å²	105.4	75%	0.749	53%	0.534	S	S	*	.			trans	-95.9	87.2	173.3	-155.5	-93.4	0	0	0	109.8	L282 T286	L282-Y284 PolarHBondContact O-N 2.94Å; Y284-T286 HydrophobicContact CD1-CG2 3.95Å; Y284-T286 HydrophobicContact CE1-CG2 3.95Å; Y284-T286 PolarHBondContact O-N 3.36Å
285	E	46.2	Very low	45.8	Very low	45 Å²	45	103.6 Å²	103.6	21%	0.21	52%	0.517	C	S	.	.			trans	-71.2	118.6	161.2	-79.3	-173.2	-165.6	0	0	108.4	R223 F225 F283 T290 Y317	R223-E285 IonicContact CZ-OE2 3.8Å; R223-E285 IonicContact NH1-OE1 3.46Å; R223-E285 PolarHBondContact NH1-OE1 3.41Å; R223-E285 IonicContact NH1-OE2 2.75Å; R223-E285 PolarHBondContact NH1-OE2 3.21Å; F225-E285 HydrophobicContact CE1-CG 4.05Å; F225-E285 WeakPolarHBondContact CE1-OE1 3.47Å; F225-E285 WeakPolarHBondContact CZ-OE1 3.44Å; F283-E285 PolarHBondContact O-N 3.08Å; E285-T290 HydrophobicContact CB-CG2 4.39Å; E285-T290 WeakPolarHBondContact OE2-CG2 3.3Å; E285-Y317 VanDerWaalsContact OE1-CE2 3.32Å; E285-Y317 WeakPolarHBondContact OE1-CE2 3.48Å; E285-Y317 VanDerWaalsContact OE1-CZ 3.29Å; E285-Y317 PolarHBondContact OE1-OH 3.45Å
286	T	54.7	Low	47.9	Very low	55 Å²	55	103.4 Å²	103.4	34%	0.337	51%	0.509	S	S	.	.			trans	-74.4	144.7	169	61.4	0	0	0	0	109.9	Y284 S288 M289 T290	Y284-T286 HydrophobicContact CD1-CG2 3.95Å; Y284-T286 HydrophobicContact CE1-CG2 3.95Å; Y284-T286 PolarHBondContact O-N 3.36Å; T286-S288 PolarHBondContact O-N 3.33Å; T286-M289 PolarHBondContact O-N 3.14Å; T286-M289 VanDerWaalsContact OG1-CG 3.29Å; T286-M289 WeakPolarHBondContact OG1-CG 3.29Å; T286-T290 PolarHBondContact O-N 3.5Å
287	E	60	Low	49.7	Very low	101 Å²	101	102.9 Å²	102.9	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-55.8	-23	175.3	178.8	174.1	179.3	0	0	112.8	T290 K291	E287-T290 WeakPolarHBondContact CA-OG1 3.39Å; E287-T290 PolarHBondContact O-OG1 3.3Å; E287-T290 VanDerWaalsContact O-OG1 3.04Å; E287-K291 VanDerWaalsContact CD-NZ 3.34Å; E287-K291 HydrophobicContact CG-CD 4.17Å; E287-K291 WeakPolarHBondContact O-CB 3.35Å; E287-K291 WeakPolarHBondContact O-CD 3.22Å; E287-K291 WeakPolarHBondContact O-CG 3.34Å; E287-K291 PolarHBondContact O-N 3.25Å; E287-K291 WeakPolarHBondContact OE1-CE 3.46Å; E287-K291 IonicContact OE1-NZ 3.94Å; E287-K291 PolarHBondContact OE1-NZ 3.14Å
288	S	62.3	Low	51.8	Low	83 Å²	83	95.7 Å²	95.7	58%	0.58	48%	0.48	S	S	*	.	H	α-helix	trans	-70	-43.4	174.5	-165.6	0	0	0	0	112.2	T286 K291 E292	T286-S288 PolarHBondContact O-N 3.33Å; S288-K291 PolarHBondContact O-N 3.33Å; S288-E292 WeakPolarHBondContact O-CB 3.39Å; S288-E292 PolarHBondContact O-N 2.89Å
289	M	59.8	Low	54.1	Low	76 Å²	76	93.1 Å²	93.1	37%	0.374	48%	0.476	S	S	.	.	H	α-helix	trans	-67.3	-41.1	-177.4	-70.8	172.1	73.2	0	0	111.9	T286 E292 W293	T286-M289 PolarHBondContact O-N 3.14Å; T286-M289 VanDerWaalsContact OG1-CG 3.29Å; T286-M289 WeakPolarHBondContact OG1-CG 3.29Å; M289-E292 PolarHBondContact O-N 3.01Å; M289-W293 WeakPolarHBondContact O-CB 3.28Å; M289-W293 PolarHBondContact O-N 3.12Å
290	T	61.7	Low	56.5	Low	5 Å²	5	91.6 Å²	91.6	3%	0.031	47%	0.469	C	S	.	.	H	α-helix	trans	-65.7	-41.1	175.6	42.9	0	0	0	0	112.1	E285 T286 E287 W293 L294 H310	E285-T290 HydrophobicContact CB-CG2 4.39Å; E285-T290 WeakPolarHBondContact OE2-CG2 3.3Å; T286-T290 PolarHBondContact O-N 3.5Å; E287-T290 WeakPolarHBondContact CA-OG1 3.39Å; E287-T290 PolarHBondContact O-OG1 3.3Å; E287-T290 VanDerWaalsContact O-OG1 3.04Å; T290-W293 PolarHBondContact O-N 3.35Å; T290-L294 WeakPolarHBondContact O-CB 3.41Å; T290-L294 VanDerWaalsContact O-CG 3.26Å; T290-L294 WeakPolarHBondContact O-CG 3.49Å; T290-L294 PolarHBondContact O-N 3.25Å; T290-H310 VanDerWaalsContact CB-CD2 3.48Å; T290-H310 WeakPolarHBondContact CB-CD2 3.36Å; T290-H310 PolarHBondContact OG1-CD2 2.84Å; T290-H310 PolarHBondContact OG1-NE2 2.66Å
291	K	67.8	Low	58.7	Low	99 Å²	99	90 Å²	90	43%	0.43	44%	0.44	S	S	.	.	H	α-helix	trans	-63.1	-44.4	174.2	-77.6	174.4	-175.8	167.9	0	112	E287 S288 L294 N295	E287-K291 VanDerWaalsContact CD-NZ 3.34Å; E287-K291 HydrophobicContact CG-CD 4.17Å; E287-K291 WeakPolarHBondContact O-CB 3.35Å; E287-K291 WeakPolarHBondContact O-CD 3.22Å; E287-K291 WeakPolarHBondContact O-CG 3.34Å; E287-K291 PolarHBondContact O-N 3.25Å; E287-K291 WeakPolarHBondContact OE1-CE 3.46Å; E287-K291 IonicContact OE1-NZ 3.94Å; E287-K291 PolarHBondContact OE1-NZ 3.14Å; S288-K291 PolarHBondContact O-N 3.33Å; K291-L294 PolarHBondContact O-N 3.11Å; K291-N295 WeakPolarHBondContact O-CB 3.34Å; K291-N295 PolarHBondContact O-N 2.73Å; K291-N295 PolarHBondContact O-ND2 3.34Å
292	E	68	Low	61.1	Low	134 Å²	134	91.7 Å²	91.7	63%	0.626	44%	0.439	S	S	*	.	H	α-helix	trans	-63	-44.4	177.4	-170.6	179	177	0	0	111.4	S288 M289 N295 R296	S288-E292 WeakPolarHBondContact O-CB 3.39Å; S288-E292 PolarHBondContact O-N 2.89Å; M289-E292 PolarHBondContact O-N 3.01Å; E292-N295 PolarHBondContact O-N 3.5Å; E292-R296 PolarHBondContact O-N 3.12Å
293	W	69.5	Low	63.3	Low	37 Å²	37	90.3 Å²	90.3	14%	0.14	43%	0.433	C	S	.	.	H	α-helix	trans	-62.4	-43.4	174.2	176.5	86.8	0	0	0	112.3	F219 R223 M289 T290 N295 R296 V297 F298 I313	F219-W293 HydrophobicContact CD1-CH2 4.41Å; R223-W293 HydrophobicContact CG-CD2 4.45Å; R223-W293 HydrophobicContact CG-CH2 4.5Å; R223-W293 HydrophobicContact CG-CZ2 3.71Å; R223-W293 VanDerWaalsContact NH2-CZ3 3.34Å; M289-W293 WeakPolarHBondContact O-CB 3.28Å; M289-W293 PolarHBondContact O-N 3.12Å; T290-W293 PolarHBondContact O-N 3.35Å; W293-N295 VanDerWaalsContact C-N 3.28Å; W293-N295 PolarHBondContact O-N 3.21Å; W293-R296 PolarHBondContact O-N 3.28Å; W293-R296 VanDerWaalsContact O-N 3.12Å; W293-V297 HydrophobicContact CD2-CG2 3.99Å; W293-V297 HydrophobicContact CG-CG2 4.22Å; W293-V297 HydrophobicContact CZ2-CG2 4Å; W293-V297 WeakPolarHBondContact O-CG2 3.3Å; W293-V297 PolarHBondContact O-N 2.78Å; W293-F298 HydrophobicContact CH2-CE2 4.35Å; W293-F298 HydrophobicContact CZ3-CE2 4.44Å; W293-I313 HydrophobicContact CZ3-CD1 3.99Å
294	L	66.5	Low	65.2	Low	3 Å²	3	89.5 Å²	89.5	2%	0.016	43%	0.429	C	S	.	.	H	α-helix	trans	-61.2	-38.6	175.5	-77.2	171.4	0	0	0	111.5	T290 K291 R296 F298 K306 V309 H310	T290-L294 WeakPolarHBondContact O-CB 3.41Å; T290-L294 VanDerWaalsContact O-CG 3.26Å; T290-L294 WeakPolarHBondContact O-CG 3.49Å; T290-L294 PolarHBondContact O-N 3.25Å; K291-L294 PolarHBondContact O-N 3.11Å; L294-R296 VanDerWaalsContact C-N 3.35Å; L294-F298 HydrophobicContact CD2-CD2 3.96Å; L294-F298 HydrophobicContact CD2-CE2 4.33Å; L294-F298 CarbonylContact O-C 3.5Å; L294-F298 WeakPolarHBondContact O-CA 3.47Å; L294-F298 WeakPolarHBondContact O-CB 3.29Å; L294-F298 PolarHBondContact O-N 3.08Å; L294-K306 HydrophobicContact CD1-CB 4.45Å; L294-K306 WeakPolarHBondContact CD1-O 3.39Å; L294-V309 HydrophobicContact CD2-CB 4.18Å; L294-V309 HydrophobicContact CD2-CG1 3.66Å; L294-H310 HydrophobicContact CD1-CB 3.92Å
295	N	72.4	Confident	66.6	Low	84 Å²	84	84.1 Å²	84.1	45%	0.449	41%	0.413	S	S	.	.	H	α-helix	trans	-68.3	-33.6	174.7	-74.5	-22.9	0	0	0	112.5	K291 E292 W293 P299 K306	K291-N295 WeakPolarHBondContact O-CB 3.34Å; K291-N295 PolarHBondContact O-N 2.73Å; K291-N295 PolarHBondContact O-ND2 3.34Å; E292-N295 PolarHBondContact O-N 3.5Å; W293-N295 VanDerWaalsContact C-N 3.28Å; W293-N295 PolarHBondContact O-N 3.21Å; N295-P299 VanDerWaalsContact O-CA 3.3Å; N295-P299 WeakPolarHBondContact O-CA 3.47Å; N295-P299 WeakPolarHBondContact O-CB 3.27Å; N295-K306 WeakPolarHBondContact OD1-CE 3.2Å; N295-K306 PolarHBondContact OD1-NZ 3.13Å
296	R	72	Confident	67.8	Low	169 Å²	169	83.1 Å²	83.1	64%	0.638	41%	0.408	S	S	*	.	H	α-helix	trans	-74.6	-43.7	177.7	-163.9	-179.7	82.4	-168.5	6.3	112.9	E292 W293 L294	E292-R296 PolarHBondContact O-N 3.12Å; W293-R296 PolarHBondContact O-N 3.28Å; W293-R296 VanDerWaalsContact O-N 3.12Å; L294-R296 VanDerWaalsContact C-N 3.35Å
297	V	62.9	Low	68.6	Low	64 Å²	64	87.8 Å²	87.8	39%	0.388	42%	0.423	S	S	.	.	H	α-helix	trans	-82.4	-38.8	-177	179.6	0	0	0	0	111.5	W293 P299	W293-V297 HydrophobicContact CD2-CG2 3.99Å; W293-V297 HydrophobicContact CG-CG2 4.22Å; W293-V297 HydrophobicContact CZ2-CG2 4Å; W293-V297 WeakPolarHBondContact O-CG2 3.3Å; W293-V297 PolarHBondContact O-N 2.78Å; V297-P299 WeakPolarHBondContact O-CD 3.36Å
298	F	69.8	Low	68.9	Low	39 Å²	39	86.5 Å²	86.5	17%	0.171	42%	0.419	C	S	.	.			trans	-124.2	63.9	-177.6	-53.2	-72.4	0	0	0	111.8	W293 L294 K300 M301 K306	W293-F298 HydrophobicContact CH2-CE2 4.35Å; W293-F298 HydrophobicContact CZ3-CE2 4.44Å; L294-F298 HydrophobicContact CD2-CD2 3.96Å; L294-F298 HydrophobicContact CD2-CE2 4.33Å; L294-F298 CarbonylContact O-C 3.5Å; L294-F298 WeakPolarHBondContact O-CA 3.47Å; L294-F298 WeakPolarHBondContact O-CB 3.29Å; L294-F298 PolarHBondContact O-N 3.08Å; F298-K300 VanDerWaalsContact C-N 3.29Å; F298-K300 PolarHBondContact O-N 3.49Å; F298-M301 HydrophobicContact CB-CB 3.82Å; F298-M301 HydrophobicContact CB-CE 3.98Å; F298-M301 HydrophobicContact CB-SD 4.34Å; F298-M301 HydrophobicContact CD1-CE 3.99Å; F298-M301 HydrophobicContact CD2-CE 4.26Å; F298-M301 HydrophobicContact CG-CE 3.82Å; F298-M301 PolarHBondContact O-N 3.3Å; F298-K306 WeakPolarHBondContact O-CE 3.44Å
299	P	71.9	Confident	69.2	Low	90 Å²	90	84 Å²	84	58%	0.584	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-37.3	-176.2	20.9	-30.9	0	0	0	112.8	N295 V297 M301	N295-P299 VanDerWaalsContact O-CA 3.3Å; N295-P299 WeakPolarHBondContact O-CA 3.47Å; N295-P299 WeakPolarHBondContact O-CB 3.27Å; V297-P299 WeakPolarHBondContact O-CD 3.36Å; P299-M301 PolarHBondContact O-N 2.68Å
300	K	73	Confident	69.6	Low	165 Å²	165	81.6 Å²	81.6	72%	0.717	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.3	-178	-63.6	-176.2	179.2	179.8	0	114.7	F298	F298-K300 VanDerWaalsContact C-N 3.29Å; F298-K300 PolarHBondContact O-N 3.49Å
301	M	70.3	Confident	70.2	Confident	48 Å²	48	86.7 Å²	86.7	24%	0.236	41%	0.41	C	S	.	.	S	Bend	trans	-76.2	136.2	-176.3	-177.4	-175	-73	0	0	111.1	F298 P299 N305 K306 V309	F298-M301 HydrophobicContact CB-CB 3.82Å; F298-M301 HydrophobicContact CB-CE 3.98Å; F298-M301 HydrophobicContact CB-SD 4.34Å; F298-M301 HydrophobicContact CD1-CE 3.99Å; F298-M301 HydrophobicContact CD2-CE 4.26Å; F298-M301 HydrophobicContact CG-CE 3.82Å; F298-M301 PolarHBondContact O-N 3.3Å; P299-M301 PolarHBondContact O-N 2.68Å; M301-N305 HydrophobicContact CG-CB 3.65Å; M301-N305 HydrophobicContact SD-CB 3.9Å; M301-K306 HydrophobicContact CB-CG 4.1Å; M301-K306 HydrophobicContact CG-CG 3.94Å; M301-K306 WeakPolarHBondContact O-CE 3.39Å; M301-K306 PolarHBondContact O-NZ 2.88Å; M301-K306 HydrophobicContact SD-CG 3.82Å; M301-V309 HydrophobicContact CE-CG2 4.45Å; M301-V309 HydrophobicContact SD-CG2 4.16Å
302	E	76.4	Confident	70.2	Confident	124 Å²	124	82.6 Å²	82.6	58%	0.579	39%	0.393	S	S	*	.			trans	-57.7	143.5	174.6	-68.8	-172.1	176.8	0	0	112.2	K304 N305 K306	E302-K304 PolarHBondContact O-N 3.27Å; E302-K304 VanDerWaalsContact O-N 3.13Å; E302-N305 PolarHBondContact O-N 3.04Å; E302-K306 PolarHBondContact O-N 2.8Å
303	D	72.6	Confident	70.1	Confident	111 Å²	111	76.3 Å²	76.3	59%	0.594	36%	0.364	S	S	*	.	H	α-helix	trans	-59.4	-28.5	179.5	-71.9	-24.6	0	0	0	113.3	K307	D303-K307 WeakPolarHBondContact O-CB 3.47Å; D303-K307 VanDerWaalsContact O-CG 3.28Å; D303-K307 WeakPolarHBondContact O-CG 3.36Å; D303-K307 PolarHBondContact O-N 3.48Å
304	K	73.4	Confident	70.2	Confident	157 Å²	157	81 Å²	81	68%	0.683	38%	0.382	S	S	*	.	H	α-helix	trans	-62.3	-46.9	172.8	-69.8	179.6	-178	172.7	0	111	E302 K307 I308	E302-K304 PolarHBondContact O-N 3.27Å; E302-K304 VanDerWaalsContact O-N 3.13Å; K304-K307 WeakPolarHBondContact O-CB 3.26Å; K304-K307 PolarHBondContact O-N 3.07Å; K304-I308 WeakPolarHBondContact O-CG1 3.24Å; K304-I308 PolarHBondContact O-N 3.28Å; K304-I308 VanDerWaalsContact O-N 3.16Å
305	N	67.6	Low	70.3	Confident	78 Å²	78	81 Å²	81	42%	0.417	38%	0.382	S	S	.	.	H	α-helix	trans	-70.6	-39.3	179.4	-67.6	-17.4	0	0	0	111.2	M301 E302 K307 I308 V309	M301-N305 HydrophobicContact CG-CB 3.65Å; M301-N305 HydrophobicContact SD-CB 3.9Å; E302-N305 PolarHBondContact O-N 3.04Å; N305-K307 VanDerWaalsContact C-N 3.3Å; N305-K307 PolarHBondContact O-N 3.04Å; N305-I308 WeakPolarHBondContact O-CB 3.43Å; N305-I308 PolarHBondContact O-N 2.72Å; N305-V309 WeakPolarHBondContact O-CG2 3.41Å; N305-V309 PolarHBondContact O-N 2.9Å
306	K	70.2	Confident	69.8	Low	23 Å²	23	78.8 Å²	78.8	10%	0.1	37%	0.368	C	S	.	.	H	α-helix	trans	-57.8	-41.1	172.2	-70	177.3	177.4	164.5	0	112	L294 N295 F298 M301 E302 I308 V309 H310	L294-K306 HydrophobicContact CD1-CB 4.45Å; L294-K306 WeakPolarHBondContact CD1-O 3.39Å; N295-K306 WeakPolarHBondContact OD1-CE 3.2Å; N295-K306 PolarHBondContact OD1-NZ 3.13Å; F298-K306 WeakPolarHBondContact O-CE 3.44Å; M301-K306 HydrophobicContact CB-CG 4.1Å; M301-K306 HydrophobicContact CG-CG 3.94Å; M301-K306 WeakPolarHBondContact O-CE 3.39Å; M301-K306 PolarHBondContact O-NZ 2.88Å; M301-K306 HydrophobicContact SD-CG 3.82Å; E302-K306 PolarHBondContact O-N 2.8Å; K306-I308 VanDerWaalsContact C-N 3.34Å; K306-I308 PolarHBondContact O-N 3.44Å; K306-V309 PolarHBondContact O-N 3.32Å; K306-H310 VanDerWaalsContact O-CB 3.24Å; K306-H310 WeakPolarHBondContact O-CB 3.35Å; K306-H310 PolarHBondContact O-N 3.12Å
307	K	71.8	Confident	69.3	Low	153 Å²	153	75 Å²	75	67%	0.665	35%	0.354	S	S	*	.	H	α-helix	trans	-63.9	-37	174.6	-76.1	174.1	-176.9	179.4	0	112.6	D303 K304 N305 K311	D303-K307 WeakPolarHBondContact O-CB 3.47Å; D303-K307 VanDerWaalsContact O-CG 3.28Å; D303-K307 WeakPolarHBondContact O-CG 3.36Å; D303-K307 PolarHBondContact O-N 3.48Å; K304-K307 WeakPolarHBondContact O-CB 3.26Å; K304-K307 PolarHBondContact O-N 3.07Å; N305-K307 VanDerWaalsContact C-N 3.3Å; N305-K307 PolarHBondContact O-N 3.04Å; K307-K311 WeakPolarHBondContact O-CB 3.31Å; K307-K311 PolarHBondContact O-N 3.07Å
308	I	67	Low	69.3	Low	74 Å²	74	75.9 Å²	75.9	38%	0.379	35%	0.354	S	S	.	.	H	α-helix	trans	-65.8	-50.5	175.8	-65.4	167.1	0	0	0	109.9	K304 N305 K306 H310 K311 V312 I330	K304-I308 WeakPolarHBondContact O-CG1 3.24Å; K304-I308 PolarHBondContact O-N 3.28Å; K304-I308 VanDerWaalsContact O-N 3.16Å; N305-I308 WeakPolarHBondContact O-CB 3.43Å; N305-I308 PolarHBondContact O-N 2.72Å; K306-I308 VanDerWaalsContact C-N 3.34Å; K306-I308 PolarHBondContact O-N 3.44Å; I308-H310 VanDerWaalsContact C-N 3.3Å; I308-H310 PolarHBondContact O-N 2.9Å; I308-K311 WeakPolarHBondContact O-CB 3.37Å; I308-K311 PolarHBondContact O-N 3.25Å; I308-V312 HydrophobicContact CG2-CG2 4.48Å; I308-V312 WeakPolarHBondContact O-CG2 3.28Å; I308-V312 PolarHBondContact O-N 3.4Å; I308-I330 HydrophobicContact CG2-CD1 3.6Å; I308-I330 HydrophobicContact CG2-CG1 4.03Å; I308-I330 HydrophobicContact CG2-CG2 4.47Å
309	V	68.8	Low	68.8	Low	31 Å²	31	75.4 Å²	75.4	19%	0.188	36%	0.356	C	S	.	.	H	α-helix	trans	-58.9	-44.3	177.8	179.2	0	0	0	0	110.6	L294 M301 N305 K306 K311 V312 I313	L294-V309 HydrophobicContact CD2-CB 4.18Å; L294-V309 HydrophobicContact CD2-CG1 3.66Å; M301-V309 HydrophobicContact CE-CG2 4.45Å; M301-V309 HydrophobicContact SD-CG2 4.16Å; N305-V309 WeakPolarHBondContact O-CG2 3.41Å; N305-V309 PolarHBondContact O-N 2.9Å; K306-V309 PolarHBondContact O-N 3.32Å; V309-K311 VanDerWaalsContact C-N 3.31Å; V309-K311 PolarHBondContact O-N 3.16Å; V309-V312 PolarHBondContact O-N 3.4Å; V309-I313 HydrophobicContact CG1-CD1 3.87Å; V309-I313 HydrophobicContact CG1-CG1 4.41Å; V309-I313 WeakPolarHBondContact O-CG1 3.44Å; V309-I313 PolarHBondContact O-N 3.29Å
310	H	68.5	Low	68.3	Low	26 Å²	26	76 Å²	76	12%	0.12	35%	0.347	C	S	.	.	H	α-helix	trans	-57	-44	174.6	-174.6	-98.7	0	0	0	112.4	T290 L294 K306 I308 I313 R314	T290-H310 VanDerWaalsContact CB-CD2 3.48Å; T290-H310 WeakPolarHBondContact CB-CD2 3.36Å; T290-H310 PolarHBondContact OG1-CD2 2.84Å; T290-H310 PolarHBondContact OG1-NE2 2.66Å; L294-H310 HydrophobicContact CD1-CB 3.92Å; K306-H310 VanDerWaalsContact O-CB 3.24Å; K306-H310 WeakPolarHBondContact O-CB 3.35Å; K306-H310 PolarHBondContact O-N 3.12Å; I308-H310 VanDerWaalsContact C-N 3.3Å; I308-H310 PolarHBondContact O-N 2.9Å; H310-I313 PolarHBondContact O-N 3.4Å; H310-R314 WeakPolarHBondContact O-CB 3.23Å; H310-R314 PolarHBondContact O-N 3.23Å
311	K	72.8	Confident	68	Low	111 Å²	111	74.9 Å²	74.9	48%	0.483	34%	0.344	S	S	.	.	H	α-helix	trans	-64.8	-39.4	177.8	-168.1	179.2	179.1	-178.6	0	112.2	K307 I308 V309 R314 S315 T326	K307-K311 WeakPolarHBondContact O-CB 3.31Å; K307-K311 PolarHBondContact O-N 3.07Å; I308-K311 WeakPolarHBondContact O-CB 3.37Å; I308-K311 PolarHBondContact O-N 3.25Å; V309-K311 VanDerWaalsContact C-N 3.31Å; V309-K311 PolarHBondContact O-N 3.16Å; K311-R314 PolarHBondContact O-N 3.4Å; K311-S315 WeakPolarHBondContact O-CB 3.43Å; K311-S315 PolarHBondContact O-N 3.49Å; K311-S315 PolarHBondContact O-OG 2.86Å; K311-T326 HydrophobicContact CD-CG2 4.19Å; K311-T326 HydrophobicContact CG-CG2 3.99Å
312	V	68	Low	68.2	Low	14 Å²	14	76.4 Å²	76.4	9%	0.085	35%	0.35	C	S	.	.	H	α-helix	trans	-67.8	-41.2	177.5	176.4	0	0	0	0	111.6	F215 I308 V309 S315 F316 F323 T326 L327 I330	F215-V312 HydrophobicContact CD2-CG1 4.46Å; F215-V312 HydrophobicContact CE2-CG1 3.65Å; F215-V312 HydrophobicContact CZ-CG1 3.78Å; I308-V312 HydrophobicContact CG2-CG2 4.48Å; I308-V312 WeakPolarHBondContact O-CG2 3.28Å; I308-V312 PolarHBondContact O-N 3.4Å; V309-V312 PolarHBondContact O-N 3.4Å; V312-S315 PolarHBondContact O-OG 3.32Å; V312-F316 PolarHBondContact O-N 3.18Å; V312-F316 VanDerWaalsContact O-N 3.1Å; V312-F323 HydrophobicContact CG1-CD2 4.15Å; V312-F323 HydrophobicContact CG1-CE2 3.57Å; V312-T326 HydrophobicContact CG2-CG2 4.11Å; V312-L327 HydrophobicContact CG1-CD2 4.35Å; V312-I330 HydrophobicContact CG2-CD1 3.35Å
313	I	67.5	Low	67.9	Low	1 Å²	1	70.5 Å²	70.5	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-45.9	175.6	-67.7	168.9	0	0	0	110.2	F215 W293 V309 H310 S315 F316 Y317	F215-I313 HydrophobicContact CZ-CG1 3.84Å; W293-I313 HydrophobicContact CZ3-CD1 3.99Å; V309-I313 HydrophobicContact CG1-CD1 3.87Å; V309-I313 HydrophobicContact CG1-CG1 4.41Å; V309-I313 WeakPolarHBondContact O-CG1 3.44Å; V309-I313 PolarHBondContact O-N 3.29Å; H310-I313 PolarHBondContact O-N 3.4Å; I313-S315 PolarHBondContact O-N 2.96Å; I313-F316 WeakPolarHBondContact O-CB 3.48Å; I313-F316 PolarHBondContact O-N 3.39Å; I313-Y317 HydrophobicContact CG2-CD2 3.97Å; I313-Y317 HydrophobicContact CG2-CE2 3.65Å; I313-Y317 VanDerWaalsContact O-CD2 3.27Å; I313-Y317 WeakPolarHBondContact O-CD2 3.48Å; I313-Y317 PolarHBondContact O-N 2.96Å
314	R	69.7	Low	67.4	Low	137 Å²	137	65.6 Å²	65.6	52%	0.517	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-47.2	178.5	-179.1	176.9	170.8	163	2.1	111.8	H310 K311 F316 Y317 E318	H310-R314 WeakPolarHBondContact O-CB 3.23Å; H310-R314 PolarHBondContact O-N 3.23Å; K311-R314 PolarHBondContact O-N 3.4Å; R314-F316 VanDerWaalsContact C-N 3.26Å; R314-F316 PolarHBondContact O-N 3.41Å; R314-Y317 PolarHBondContact O-N 3.17Å; R314-Y317 VanDerWaalsContact O-N 3.12Å; R314-E318 HydrophobicContact CG-CG 4.39Å; R314-E318 IonicContact CZ-OE1 3.61Å; R314-E318 IonicContact NE-OE1 3.08Å; R314-E318 PolarHBondContact NE-OE1 3.37Å; R314-E318 IonicContact NH2-OE1 3.71Å; R314-E318 PolarHBondContact NH2-OE1 2.98Å; R314-E318 VanDerWaalsContact NH2-OE1 3.14Å; R314-E318 WeakPolarHBondContact O-CG 3.49Å; R314-E318 PolarHBondContact O-N 2.55Å; R314-E318 VanDerWaalsContact O-N 3.08Å
315	S	68.7	Low	67.2	Low	3 Å²	3	60.7 Å²	60.7	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-66.3	-28.8	-179.6	63.6	0	0	0	0	113	K311 V312 I313 E318 S319 T326	K311-S315 WeakPolarHBondContact O-CB 3.43Å; K311-S315 PolarHBondContact O-N 3.49Å; K311-S315 PolarHBondContact O-OG 2.86Å; V312-S315 PolarHBondContact O-OG 3.32Å; I313-S315 PolarHBondContact O-N 2.96Å; S315-E318 PolarHBondContact O-N 3.42Å; S315-S319 PolarHBondContact O-N 3.42Å; S315-T326 VanDerWaalsContact CB-OG1 3.26Å; S315-T326 WeakPolarHBondContact CB-OG1 3.06Å; S315-T326 PolarHBondContact OG-OG1 2.64Å
316	F	63.2	Low	67.2	Low	36 Å²	36	57.5 Å²	57.5	16%	0.158	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-39.7	171.9	-170.7	-85.9	0	0	0	112.6	E212 F215 Y216 L220 V312 I313 R314 F323	E212-F316 HydrophobicContact CB-CE2 4.18Å; E212-F316 HydrophobicContact CG-CE2 4.19Å; F215-F316 HydrophobicContact CD1-CB 4.29Å; F215-F316 HydrophobicContact CD1-CD1 4.48Å; F215-F316 AromaticContact CD1-CD2 3.5Å; F215-F316 HydrophobicContact CD1-CD2 3.5Å; F215-F316 AromaticContact CD1-CE2 3.89Å; F215-F316 HydrophobicContact CD1-CE2 3.89Å; F215-F316 AromaticContact CD1-CG 3.83Å; F215-F316 HydrophobicContact CD1-CG 3.83Å; F215-F316 HydrophobicContact CE1-CB 3.87Å; F215-F316 AromaticContact CE1-CD2 3.99Å; F215-F316 HydrophobicContact CE1-CD2 3.99Å; F215-F316 AromaticContact CE1-CG 3.87Å; F215-F316 HydrophobicContact CE1-CG 3.87Å; F215-F316 HydrophobicContact CG-CD2 4.4Å; Y216-F316 HydrophobicContact CD2-CE1 4.06Å; Y216-F316 HydrophobicContact CD2-CZ 4.17Å; L220-F316 HydrophobicContact CD1-CD1 3.36Å; L220-F316 HydrophobicContact CD1-CE1 3.25Å; L220-F316 HydrophobicContact CD1-CG 4.29Å; L220-F316 HydrophobicContact CD1-CZ 4.12Å; V312-F316 PolarHBondContact O-N 3.18Å; V312-F316 VanDerWaalsContact O-N 3.1Å; I313-F316 WeakPolarHBondContact O-CB 3.48Å; I313-F316 PolarHBondContact O-N 3.39Å; R314-F316 VanDerWaalsContact C-N 3.26Å; R314-F316 PolarHBondContact O-N 3.41Å; F316-F323 HydrophobicContact CB-CD2 3.78Å; F316-F323 HydrophobicContact CB-CE2 4.2Å; F316-F323 HydrophobicContact CB-CG 4.41Å; F316-F323 HydrophobicContact CD2-CD1 4.19Å; F316-F323 AromaticContact CD2-CD2 3.81Å; F316-F323 HydrophobicContact CD2-CD2 3.81Å; F316-F323 HydrophobicContact CD2-CE1 4.21Å; F316-F323 AromaticContact CD2-CE2 3.82Å; F316-F323 HydrophobicContact CD2-CE2 3.82Å; F316-F323 AromaticContact CD2-CG 3.99Å; F316-F323 HydrophobicContact CD2-CG 3.99Å; F316-F323 HydrophobicContact CD2-CZ 4.02Å; F316-F323 HydrophobicContact CG-CD2 4.31Å; F316-F323 HydrophobicContact CG-CE2 4.5Å
317	Y	60.3	Low	66.8	Low	90 Å²	90	58 Å²	58	35%	0.353	27%	0.269	S	S	.	.	H	α-helix	trans	-76.1	-30.3	177.9	-72.5	-60.5	0	0	0	113.7	L220 F225 E285 I313 R314	L220-Y317 HydrophobicContact CD1-CE1 4.36Å; L220-Y317 HydrophobicContact CD2-CE1 4.46Å; L220-Y317 HydrophobicContact CD2-CE2 4.12Å; L220-Y317 WeakPolarHBondContact CD2-OH 3.03Å; F225-Y317 WeakPolarHBondContact CZ-OH 3.46Å; E285-Y317 VanDerWaalsContact OE1-CE2 3.32Å; E285-Y317 WeakPolarHBondContact OE1-CE2 3.48Å; E285-Y317 VanDerWaalsContact OE1-CZ 3.29Å; E285-Y317 PolarHBondContact OE1-OH 3.45Å; I313-Y317 HydrophobicContact CG2-CD2 3.97Å; I313-Y317 HydrophobicContact CG2-CE2 3.65Å; I313-Y317 VanDerWaalsContact O-CD2 3.27Å; I313-Y317 WeakPolarHBondContact O-CD2 3.48Å; I313-Y317 PolarHBondContact O-N 2.96Å; R314-Y317 PolarHBondContact O-N 3.17Å; R314-Y317 VanDerWaalsContact O-N 3.12Å
318	E	63.4	Low	66.3	Low	82 Å²	82	51.3 Å²	51.3	38%	0.383	24%	0.241	S	C	.	.	H	α-helix	trans	-73	-61.6	179.2	-65.9	170.5	159	0	0	110.7	R314 S315 E322	R314-E318 HydrophobicContact CG-CG 4.39Å; R314-E318 IonicContact CZ-OE1 3.61Å; R314-E318 IonicContact NE-OE1 3.08Å; R314-E318 PolarHBondContact NE-OE1 3.37Å; R314-E318 IonicContact NH2-OE1 3.71Å; R314-E318 PolarHBondContact NH2-OE1 2.98Å; R314-E318 VanDerWaalsContact NH2-OE1 3.14Å; R314-E318 WeakPolarHBondContact O-CG 3.49Å; R314-E318 PolarHBondContact O-N 2.55Å; R314-E318 VanDerWaalsContact O-N 3.08Å; S315-E318 PolarHBondContact O-N 3.42Å; E318-E322 WeakPolarHBondContact CB-OE2 3.34Å
319	S	59	Low	66.3	Low	30 Å²	30	49.8 Å²	49.8	21%	0.21	24%	0.237	C	C	.	.			trans	-162	155.1	178.2	67.3	0	0	0	0	113.9	S315 E321 E322 F323	S315-S319 PolarHBondContact O-N 3.42Å; S319-E321 PolarHBondContact O-N 2.9Å; S319-E322 PolarHBondContact O-N 3.29Å; S319-E322 VanDerWaalsContact OG-CB 3.29Å; S319-E322 WeakPolarHBondContact OG-CB 3.22Å; S319-E322 VanDerWaalsContact OG-CG 3.27Å; S319-E322 WeakPolarHBondContact OG-CG 3.3Å; S319-E322 PolarHBondContact OG-N 3.02Å; S319-E322 VanDerWaalsContact OG-N 3.11Å; S319-E322 PolarHBondContact OG-OE2 3.22Å; S319-F323 PolarHBondContact O-N 3.37Å
320	R	62.4	Low	66	Low	103 Å²	103	50.8 Å²	50.8	39%	0.389	24%	0.24	S	C	.	.	H	α-helix	trans	-54.8	-41.3	172.8	-179.4	172	-172.1	-167.1	3.6	111.8	S205 S209 E212 F323 V324	S205-R320 PolarHBondContact O-NH2 3.04Å; S209-R320 PolarHBondContact OG-NH2 3.01Å; E212-R320 WeakPolarHBondContact OE1-CD 3.47Å; E212-R320 WeakPolarHBondContact OE1-CG 3.44Å; E212-R320 IonicContact OE1-CZ 3.42Å; E212-R320 IonicContact OE1-NE 2.73Å; E212-R320 PolarHBondContact OE1-NE 3.34Å; E212-R320 IonicContact OE1-NH2 2.78Å; E212-R320 IonicContact OE2-NE 3.14Å; E212-R320 PolarHBondContact OE2-NE 3.5Å; R320-F323 PolarHBondContact O-N 3.25Å; R320-V324 WeakPolarHBondContact O-CG2 3.38Å; R320-V324 PolarHBondContact O-N 2.99Å; R320-V324 VanDerWaalsContact O-N 3.11Å
321	E	67.2	Low	65.2	Low	140 Å²	140	52.9 Å²	52.9	65%	0.654	25%	0.252	S	S	*	.	H	α-helix	trans	-67.1	-40	-178.9	-62.3	-169.8	177.7	0	0	112.4	S319 S325	S319-E321 PolarHBondContact O-N 2.9Å; E321-S325 VanDerWaalsContact O-CB 3.28Å; E321-S325 WeakPolarHBondContact O-CB 3.41Å; E321-S325 PolarHBondContact O-N 3.11Å; E321-S325 PolarHBondContact O-OG 2.92Å
322	E	74.6	Confident	64.2	Low	80 Å²	80	52.3 Å²	52.3	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-69.4	-38	176.4	-77.6	172.1	138.2	0	0	112	E318 S319 S325 T326	E318-E322 WeakPolarHBondContact CB-OE2 3.34Å; S319-E322 PolarHBondContact O-N 3.29Å; S319-E322 VanDerWaalsContact OG-CB 3.29Å; S319-E322 WeakPolarHBondContact OG-CB 3.22Å; S319-E322 VanDerWaalsContact OG-CG 3.27Å; S319-E322 WeakPolarHBondContact OG-CG 3.3Å; S319-E322 PolarHBondContact OG-N 3.02Å; S319-E322 VanDerWaalsContact OG-N 3.11Å; S319-E322 PolarHBondContact OG-OE2 3.22Å; E322-S325 WeakPolarHBondContact CA-OG 3.5Å; E322-S325 PolarHBondContact O-N 3.08Å; E322-S325 PolarHBondContact O-OG 3.43Å; E322-T326 VanDerWaalsContact O-CB 3.27Å; E322-T326 WeakPolarHBondContact O-CB 3.49Å; E322-T326 PolarHBondContact O-N 2.99Å; E322-T326 PolarHBondContact O-OG1 3.24Å
323	F	69.2	Low	63.6	Low	1 Å²	1	58.3 Å²	58.3	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-57	-54.2	173.7	-179.7	-113.9	0	0	0	111.6	L211 E212 F215 V312 F316 S319 R320 S325 T326 L327	L211-F323 HydrophobicContact CD2-CE1 3.75Å; L211-F323 HydrophobicContact CD2-CZ 3.85Å; E212-F323 HydrophobicContact CG-CD1 3.82Å; E212-F323 HydrophobicContact CG-CE1 3.75Å; F215-F323 HydrophobicContact CB-CZ 4.04Å; F215-F323 HydrophobicContact CD1-CE2 4.06Å; F215-F323 HydrophobicContact CD1-CZ 4.2Å; F215-F323 HydrophobicContact CD2-CE2 4.23Å; F215-F323 HydrophobicContact CD2-CZ 4.19Å; F215-F323 HydrophobicContact CE1-CE2 4.22Å; F215-F323 HydrophobicContact CE2-CE2 4.39Å; F215-F323 HydrophobicContact CG-CE2 4.06Å; F215-F323 AromaticContact CG-CZ 3.87Å; F215-F323 HydrophobicContact CG-CZ 3.87Å; F215-F323 HydrophobicContact CZ-CE2 4.38Å; V312-F323 HydrophobicContact CG1-CD2 4.15Å; V312-F323 HydrophobicContact CG1-CE2 3.57Å; F316-F323 HydrophobicContact CB-CD2 3.78Å; F316-F323 HydrophobicContact CB-CE2 4.2Å; F316-F323 HydrophobicContact CB-CG 4.41Å; F316-F323 HydrophobicContact CD2-CD1 4.19Å; F316-F323 AromaticContact CD2-CD2 3.81Å; F316-F323 HydrophobicContact CD2-CD2 3.81Å; F316-F323 HydrophobicContact CD2-CE1 4.21Å; F316-F323 AromaticContact CD2-CE2 3.82Å; F316-F323 HydrophobicContact CD2-CE2 3.82Å; F316-F323 AromaticContact CD2-CG 3.99Å; F316-F323 HydrophobicContact CD2-CG 3.99Å; F316-F323 HydrophobicContact CD2-CZ 4.02Å; F316-F323 HydrophobicContact CG-CD2 4.31Å; F316-F323 HydrophobicContact CG-CE2 4.5Å; S319-F323 PolarHBondContact O-N 3.37Å; R320-F323 PolarHBondContact O-N 3.25Å; F323-S325 VanDerWaalsContact C-N 3.35Å; F323-S325 PolarHBondContact O-N 3.14Å; F323-T326 PolarHBondContact O-N 3.11Å; F323-L327 HydrophobicContact CD1-CD1 4.09Å; F323-L327 HydrophobicContact CE1-CD1 3.62Å; F323-L327 HydrophobicContact CE2-CD1 4.17Å; F323-L327 HydrophobicContact CE2-CG 4.48Å; F323-L327 HydrophobicContact CZ-CD1 3.67Å; F323-L327 HydrophobicContact CZ-CG 4.44Å; F323-L327 WeakPolarHBondContact O-CG 3.34Å; F323-L327 PolarHBondContact O-N 3.29Å
324	V	62.8	Low	62.6	Low	7 Å²	7	61.6 Å²	61.6	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-60.9	-43.3	177.1	175.6	0	0	0	0	111.1	W208 R320 T326 L327 L328	W208-V324 HydrophobicContact CB-CG2 4.41Å; W208-V324 HydrophobicContact CD2-CG1 3.99Å; W208-V324 HydrophobicContact CD2-CG2 3.92Å; W208-V324 HydrophobicContact CE3-CB 4.43Å; W208-V324 HydrophobicContact CE3-CG1 4.02Å; W208-V324 HydrophobicContact CE3-CG2 3.8Å; W208-V324 HydrophobicContact CG-CG2 4.2Å; W208-V324 HydrophobicContact CH2-CG1 3.95Å; W208-V324 HydrophobicContact CZ2-CG1 3.91Å; W208-V324 HydrophobicContact CZ3-CG1 4.01Å; W208-V324 HydrophobicContact CZ3-CG2 4.42Å; R320-V324 WeakPolarHBondContact O-CG2 3.38Å; R320-V324 PolarHBondContact O-N 2.99Å; R320-V324 VanDerWaalsContact O-N 3.11Å; V324-T326 VanDerWaalsContact C-N 3.3Å; V324-T326 PolarHBondContact O-N 3.23Å; V324-L327 PolarHBondContact O-N 3.16Å; V324-L328 HydrophobicContact CG1-CD1 3.93Å; V324-L328 HydrophobicContact CG1-CG 4.42Å; V324-L328 WeakPolarHBondContact O-CB 3.21Å; V324-L328 WeakPolarHBondContact O-CG 2.97Å; V324-L328 PolarHBondContact O-N 3.38Å
325	S	68.2	Low	61.1	Low	54 Å²	54	58.1 Å²	58.1	38%	0.378	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-35.7	178.4	80.3	0	0	0	0	112.8	E321 E322 F323 S329	E321-S325 VanDerWaalsContact O-CB 3.28Å; E321-S325 WeakPolarHBondContact O-CB 3.41Å; E321-S325 PolarHBondContact O-N 3.11Å; E321-S325 PolarHBondContact O-OG 2.92Å; E322-S325 WeakPolarHBondContact CA-OG 3.5Å; E322-S325 PolarHBondContact O-N 3.08Å; E322-S325 PolarHBondContact O-OG 3.43Å; F323-S325 VanDerWaalsContact C-N 3.35Å; F323-S325 PolarHBondContact O-N 3.14Å; S325-S329 WeakPolarHBondContact O-CB 3.46Å; S325-S329 PolarHBondContact O-N 2.72Å
326	T	67.6	Low	59.7	Low	11 Å²	11	62.3 Å²	62.3	7%	0.067	32%	0.32	C	S	.	.	H	α-helix	trans	-69.7	-45	179	-60.8	0	0	0	0	110.1	K311 V312 S315 E322 F323 V324 S329 I330	K311-T326 HydrophobicContact CD-CG2 4.19Å; K311-T326 HydrophobicContact CG-CG2 3.99Å; V312-T326 HydrophobicContact CG2-CG2 4.11Å; S315-T326 VanDerWaalsContact CB-OG1 3.26Å; S315-T326 WeakPolarHBondContact CB-OG1 3.06Å; S315-T326 PolarHBondContact OG-OG1 2.64Å; E322-T326 VanDerWaalsContact O-CB 3.27Å; E322-T326 WeakPolarHBondContact O-CB 3.49Å; E322-T326 PolarHBondContact O-N 2.99Å; E322-T326 PolarHBondContact O-OG1 3.24Å; F323-T326 PolarHBondContact O-N 3.11Å; V324-T326 VanDerWaalsContact C-N 3.3Å; V324-T326 PolarHBondContact O-N 3.23Å; T326-S329 WeakPolarHBondContact O-CB 3.3Å; T326-S329 PolarHBondContact O-N 3.1Å; T326-I330 HydrophobicContact CG2-CD1 3.99Å; T326-I330 WeakPolarHBondContact O-CD1 3.49Å; T326-I330 VanDerWaalsContact O-CG1 3.25Å; T326-I330 WeakPolarHBondContact O-CG1 3.49Å; T326-I330 PolarHBondContact O-N 3.31Å
327	L	62.7	Low	58.2	Low	34 Å²	34	68.9 Å²	68.9	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-59.9	-47.4	174.3	-71.2	174.3	0	0	0	111.4	W208 L211 V312 F323 V324 S329 I330 I331	W208-L327 HydrophobicContact CZ3-CD1 4.31Å; L211-L327 HydrophobicContact CD2-CD1 3.53Å; V312-L327 HydrophobicContact CG1-CD2 4.35Å; F323-L327 HydrophobicContact CD1-CD1 4.09Å; F323-L327 HydrophobicContact CE1-CD1 3.62Å; F323-L327 HydrophobicContact CE2-CD1 4.17Å; F323-L327 HydrophobicContact CE2-CG 4.48Å; F323-L327 HydrophobicContact CZ-CD1 3.67Å; F323-L327 HydrophobicContact CZ-CG 4.44Å; F323-L327 WeakPolarHBondContact O-CG 3.34Å; F323-L327 PolarHBondContact O-N 3.29Å; V324-L327 PolarHBondContact O-N 3.16Å; L327-S329 VanDerWaalsContact C-N 3.3Å; L327-S329 PolarHBondContact O-N 3.03Å; L327-I330 PolarHBondContact O-N 2.97Å; L327-I330 VanDerWaalsContact O-N 3.11Å; L327-I331 VanDerWaalsContact O-CG1 3.29Å; L327-I331 WeakPolarHBondContact O-CG1 3.44Å; L327-I331 PolarHBondContact O-N 3.11Å
328	L	61.6	Low	56.6	Low	13 Å²	13	67.8 Å²	67.8	7%	0.068	35%	0.353	C	S	.	.	H	α-helix	trans	-61.5	-37.6	175.6	-72.1	171.2	0	0	0	112.2	I198 K200 W208 V324 I330 I331 K332	I198-L328 HydrophobicContact CB-CD2 4.27Å; I198-L328 HydrophobicContact CG2-CD2 3.82Å; K200-L328 HydrophobicContact CG-CD1 3.99Å; W208-L328 HydrophobicContact CH2-CD2 4.18Å; W208-L328 HydrophobicContact CH2-CG 4.29Å; W208-L328 HydrophobicContact CZ2-CD2 4.5Å; V324-L328 HydrophobicContact CG1-CD1 3.93Å; V324-L328 HydrophobicContact CG1-CG 4.42Å; V324-L328 WeakPolarHBondContact O-CB 3.21Å; V324-L328 WeakPolarHBondContact O-CG 2.97Å; V324-L328 PolarHBondContact O-N 3.38Å; L328-I330 VanDerWaalsContact C-N 3.35Å; L328-I331 PolarHBondContact O-N 3.38Å; L328-K332 WeakPolarHBondContact O-CB 3.4Å; L328-K332 VanDerWaalsContact O-CG 3.3Å; L328-K332 WeakPolarHBondContact O-CG 3.27Å; L328-K332 PolarHBondContact O-N 2.86Å
329	S	67	Low	54.7	Low	42 Å²	42	66.2 Å²	66.2	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-65.9	-36.6	174.3	175.6	0	0	0	0	112.5	S325 T326 L327 K333	S325-S329 WeakPolarHBondContact O-CB 3.46Å; S325-S329 PolarHBondContact O-N 2.72Å; T326-S329 WeakPolarHBondContact O-CB 3.3Å; T326-S329 PolarHBondContact O-N 3.1Å; L327-S329 VanDerWaalsContact C-N 3.3Å; L327-S329 PolarHBondContact O-N 3.03Å; S329-K333 WeakPolarHBondContact O-CB 3.28Å; S329-K333 WeakPolarHBondContact O-CG 3.42Å; S329-K333 PolarHBondContact O-N 3.2Å
330	I	60.9	Low	53.1	Low	51 Å²	51	70.4 Å²	70.4	26%	0.262	38%	0.378	S	S	.	.	H	α-helix	trans	-68.3	-47.2	177	-68.3	160.2	0	0	0	109.4	I308 V312 T326 L327 L328 K332 K333 S334	I308-I330 HydrophobicContact CG2-CD1 3.6Å; I308-I330 HydrophobicContact CG2-CG1 4.03Å; I308-I330 HydrophobicContact CG2-CG2 4.47Å; V312-I330 HydrophobicContact CG2-CD1 3.35Å; T326-I330 HydrophobicContact CG2-CD1 3.99Å; T326-I330 WeakPolarHBondContact O-CD1 3.49Å; T326-I330 VanDerWaalsContact O-CG1 3.25Å; T326-I330 WeakPolarHBondContact O-CG1 3.49Å; T326-I330 PolarHBondContact O-N 3.31Å; L327-I330 PolarHBondContact O-N 2.97Å; L327-I330 VanDerWaalsContact O-N 3.11Å; L328-I330 VanDerWaalsContact C-N 3.35Å; I330-K332 VanDerWaalsContact C-N 3.34Å; I330-K332 PolarHBondContact O-N 3.5Å; I330-K333 PolarHBondContact O-N 2.84Å; I330-K333 VanDerWaalsContact O-N 3.14Å; I330-S334 PolarHBondContact O-N 2.96Å; I330-S334 PolarHBondContact O-OG 3.06Å
331	I	52	Low	51.1	Low	71 Å²	71	75 Å²	75	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-58.4	-46.4	175.9	-65.5	164.2	0	0	0	110.4	I198 L327 L328 K333 S334 V335	I198-I331 HydrophobicContact CD1-CG2 3.81Å; L327-I331 VanDerWaalsContact O-CG1 3.29Å; L327-I331 WeakPolarHBondContact O-CG1 3.44Å; L327-I331 PolarHBondContact O-N 3.11Å; L328-I331 PolarHBondContact O-N 3.38Å; I331-K333 VanDerWaalsContact C-N 3.34Å; I331-K333 PolarHBondContact O-N 3.49Å; I331-S334 WeakPolarHBondContact CA-OG 3.31Å; I331-S334 PolarHBondContact O-N 2.97Å; I331-S334 PolarHBondContact O-OG 3.45Å; I331-V335 HydrophobicContact CG2-CG2 4.18Å; I331-V335 WeakPolarHBondContact O-CB 3.14Å; I331-V335 WeakPolarHBondContact O-CG2 3.43Å; I331-V335 PolarHBondContact O-N 3.38Å
332	K	52.4	Low	49	Very low	99 Å²	99	72.3 Å²	72.3	43%	0.43	40%	0.4	S	S	.	.	H	α-helix	trans	-57.5	-47.1	175.5	-78.7	178.9	-179	-178.8	0	111.3	L328 I330 V335 C336	L328-K332 WeakPolarHBondContact O-CB 3.4Å; L328-K332 VanDerWaalsContact O-CG 3.3Å; L328-K332 WeakPolarHBondContact O-CG 3.27Å; L328-K332 PolarHBondContact O-N 2.86Å; I330-K332 VanDerWaalsContact C-N 3.34Å; I330-K332 PolarHBondContact O-N 3.5Å; K332-V335 PolarHBondContact O-N 2.94Å; K332-C336 PolarHBondContact O-N 3.21Å; K332-C336 PolarHBondContact O-SG 2.95Å
333	K	55.3	Low	46.5	Very low	139 Å²	139	77 Å²	77	60%	0.604	42%	0.422	S	S	*	.	H	α-helix	trans	-64.7	-38	179.1	-78.8	-174.7	178.6	-169.5	0	113.4	S329 I330 I331 H337	S329-K333 WeakPolarHBondContact O-CB 3.28Å; S329-K333 WeakPolarHBondContact O-CG 3.42Å; S329-K333 PolarHBondContact O-N 3.2Å; I330-K333 PolarHBondContact O-N 2.84Å; I330-K333 VanDerWaalsContact O-N 3.14Å; I331-K333 VanDerWaalsContact C-N 3.34Å; I331-K333 PolarHBondContact O-N 3.49Å; K333-H337 PolarHBondContact O-CD2 3.22Å
334	S	46.5	Very low	44.2	Very low	70 Å²	70	84.4 Å²	84.4	49%	0.49	46%	0.46	S	S	.	.	H	α-helix	trans	-71.4	-35.9	176.5	56.2	0	0	0	0	111.8	I330 I331	I330-S334 PolarHBondContact O-N 2.96Å; I330-S334 PolarHBondContact O-OG 3.06Å; I331-S334 WeakPolarHBondContact CA-OG 3.31Å; I331-S334 PolarHBondContact O-N 2.97Å; I331-S334 PolarHBondContact O-OG 3.45Å
335	V	38.2	Very low	42.3	Very low	64 Å²	64	90 Å²	90	39%	0.388	49%	0.493	S	S	.	.	H	α-helix	trans	-75	-37.3	-179.1	175.1	0	0	0	0	112.4	L194 I331 K332 H337 V338 G339	L194-V335 HydrophobicContact CD1-CG1 4.22Å; I331-V335 HydrophobicContact CG2-CG2 4.18Å; I331-V335 WeakPolarHBondContact O-CB 3.14Å; I331-V335 WeakPolarHBondContact O-CG2 3.43Å; I331-V335 PolarHBondContact O-N 3.38Å; K332-V335 PolarHBondContact O-N 2.94Å; V335-H337 PolarHBondContact O-N 2.87Å; V335-H337 VanDerWaalsContact O-N 3.17Å; V335-V338 PolarHBondContact O-N 3.41Å; V335-G339 PolarHBondContact O-N 2.88Å
336	C	38.6	Very low	40.1	Very low	92 Å²	92	91.8 Å²	91.8	62%	0.622	51%	0.506	S	S	*	.	H	α-helix	trans	-67.6	-13.6	177	47.8	0	0	0	0	114.1	K332	K332-C336 PolarHBondContact O-N 3.21Å; K332-C336 PolarHBondContact O-SG 2.95Å
337	H	31.4	Very low	38.1	Very low	174 Å²	174	100.1 Å²	100.1	81%	0.806	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16.3	167.8	-83.7	-60.2	0	0	0	114.3	K333 V335	K333-H337 PolarHBondContact O-CD2 3.22Å; V335-H337 PolarHBondContact O-N 2.87Å; V335-H337 VanDerWaalsContact O-N 3.17Å
338	V	27.5	Very low	36.2	Very low	66 Å²	66	103.1 Å²	103.1	40%	0.4	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.5	-7.4	175.4	-171.1	0	0	0	0	111.2	V335 I340 E976	V335-V338 PolarHBondContact O-N 3.41Å; V338-I340 PolarHBondContact O-N 2.97Å; V338-E976 WeakPolarHBondContact CG1-OE2 3.33Å
339	G	24.3	Very low	34.5	Very low	49 Å²	49	114.7 Å²	114.7	51%	0.505	61%	0.611	S	S	.	*	S	Bend	trans	-64	101.2	171.9	0	0	0	0	0	111	V335 Q341	V335-G339 PolarHBondContact O-N 2.88Å; G339-Q341 PolarHBondContact O-N 3.45Å
340	I	23.8	Very low	32.6	Very low	119 Å²	119	116.2 Å²	116.2	61%	0.61	63%	0.633	S	S	*	*			trans	-15.8	120.3	161.5	-57.1	167.5	0	0	0	110.7	V338 S342	V338-I340 PolarHBondContact O-N 2.97Å; I340-S342 PolarHBondContact O-N 2.89Å
341	Q	21.2	Very low	31.1	Very low	199 Å²	199	116.6 Å²	116.6	93%	0.93	64%	0.64	S	S	*	*			trans	-61.1	70.6	157.4	-79.7	176.4	-34.8	0	0	107.8	G339 Q343	G339-Q341 PolarHBondContact O-N 3.45Å; Q341-Q343 PolarHBondContact O-N 3.19Å; Q341-Q343 VanDerWaalsContact O-N 3.11Å
342	S	22.8	Very low	30.3	Very low	83 Å²	83	115.6 Å²	115.6	58%	0.58	64%	0.639	S	S	*	*			trans	-70.4	111	164.6	54.7	0	0	0	0	103.6	I340 I344	I340-S342 PolarHBondContact O-N 2.89Å; S342-I344 VanDerWaalsContact C-N 3.34Å; S342-I344 PolarHBondContact O-N 3.41Å
343	Q	21.8	Very low	29.7	Very low	180 Å²	180	115.7 Å²	115.7	84%	0.841	65%	0.65	S	S	*	*			trans	-46.4	109	164	-77	176.7	-30.5	0	0	106.3	Q341 V345	Q341-Q343 PolarHBondContact O-N 3.19Å; Q341-Q343 VanDerWaalsContact O-N 3.11Å; Q343-V345 PolarHBondContact O-N 2.99Å
344	I	21.8	Very low	28.8	Very low	156 Å²	156	114.5 Å²	114.5	80%	0.8	65%	0.649	S	S	*	*			trans	-65.8	90.1	177.2	-64.9	164.9	0	0	0	104.9	S342 S346	S342-I344 VanDerWaalsContact C-N 3.34Å; S342-I344 PolarHBondContact O-N 3.41Å; I344-S346 PolarHBondContact O-N 3.49Å
345	V	22.5	Very low	28.4	Very low	123 Å²	123	115.4 Å²	115.4	75%	0.745	65%	0.648	S	S	*	*			trans	-72.9	93.5	160.9	-179.2	0	0	0	0	104.6	Q343 Q347	Q343-V345 PolarHBondContact O-N 2.99Å; V345-Q347 PolarHBondContact O-N 2.84Å; V345-Q347 VanDerWaalsContact O-N 3.16Å
346	S	23	Very low	28.8	Very low	92 Å²	92	118.3 Å²	118.3	64%	0.643	66%	0.655	S	S	*	*			trans	-35.2	111.7	169.6	51.4	0	0	0	0	112.8	I344	I344-S346 PolarHBondContact O-N 3.49Å
347	Q	24.4	Very low	29.2	Very low	186 Å²	186	118.7 Å²	118.7	87%	0.869	65%	0.648	S	S	*	*			trans	-129.4	84	146.8	-72.2	-163	0.7	0	0	108.7	V345 R349	V345-Q347 PolarHBondContact O-N 2.84Å; V345-Q347 VanDerWaalsContact O-N 3.16Å; Q347-R349 PolarHBondContact O-N 3.32Å
348	S	24.1	Very low	29.7	Very low	98 Å²	98	113.4 Å²	113.4	69%	0.685	63%	0.625	S	S	*	*			trans	-59.1	110.7	171.2	51.7	0	0	0	0	111.7
349	R	25.9	Very low	30.7	Very low	255 Å²	255	115.2 Å²	115.2	96%	0.962	63%	0.629	S	S	*	*			trans	-142.1	79.6	157	-71.8	-167.3	179.9	-178.7	1.5	109.5	Q347	Q347-R349 PolarHBondContact O-N 3.32Å
350	G	26.5	Very low	32.1	Very low	74 Å²	74	119.2 Å²	119.2	76%	0.763	63%	0.633	S	S	*	*			trans	163	20.6	173.7	0	0	0	0	0	117.3	S352	G350-S352 PolarHBondContact O-N 3.22Å; G350-S352 VanDerWaalsContact O-N 3.11Å
351	C	29.6	Very low	33.5	Very low	59 Å²	59	115 Å²	115	40%	0.399	61%	0.613	S	S	.	*			trans	-65.1	115.4	172.3	-63.3	0	0	0	0	108.7
352	S	34	Very low	35.1	Very low	50 Å²	50	108.6 Å²	108.6	35%	0.35	59%	0.593	S	S	.	*			trans	-51.6	145.5	172.4	62.2	0	0	0	0	109.5	G350 I354 L355 K356	G350-S352 PolarHBondContact O-N 3.22Å; G350-S352 VanDerWaalsContact O-N 3.11Å; S352-I354 PolarHBondContact O-N 2.63Å; S352-L355 PolarHBondContact O-N 2.74Å; S352-K356 PolarHBondContact O-N 3.49Å
353	P	41	Very low	36.5	Very low	102 Å²	102	108.8 Å²	108.8	66%	0.662	60%	0.595	S	S	*	*	H	α-helix	trans	-54.8	-20.6	178.7	18.3	-29.3	0	0	0	113.1	K356 E357	P353-K356 PolarHBondContact O-N 3.29Å; P353-E357 PolarHBondContact O-N 2.86Å; P353-E357 VanDerWaalsContact O-N 3.08Å
354	I	37	Very low	38.1	Very low	113 Å²	113	103.3 Å²	103.3	58%	0.579	57%	0.571	S	S	*	*	H	α-helix	trans	-63.6	-46.9	175.3	-56.5	169.3	0	0	0	111.7	S352 K356 E357 I358	S352-I354 PolarHBondContact O-N 2.63Å; I354-K356 VanDerWaalsContact C-N 3.33Å; I354-E357 PolarHBondContact O-N 2.81Å; I354-I358 PolarHBondContact O-N 3.13Å
355	L	37.5	Very low	39.5	Very low	90 Å²	90	100.6 Å²	100.6	47%	0.471	56%	0.564	S	S	.	*	H	α-helix	trans	-69.3	-34.6	175.7	-87.2	160.9	0	0	0	111.1	S352 E357 I358 E359	S352-L355 PolarHBondContact O-N 2.74Å; L355-E357 VanDerWaalsContact C-N 3.31Å; L355-E357 PolarHBondContact O-N 3.35Å; L355-I358 PolarHBondContact O-N 2.91Å; L355-E359 WeakPolarHBondContact O-CB 3.07Å; L355-E359 WeakPolarHBondContact O-CG 3.34Å; L355-E359 PolarHBondContact O-N 3.04Å
356	K	46.5	Very low	41.2	Very low	124 Å²	124	99.6 Å²	99.6	54%	0.539	55%	0.554	S	S	.	*	H	α-helix	trans	-61.5	-37.9	176.3	-74	-173.1	176.1	-178.5	0	112.6	S352 P353 I354 E359 K360	S352-K356 PolarHBondContact O-N 3.49Å; P353-K356 PolarHBondContact O-N 3.29Å; I354-K356 VanDerWaalsContact C-N 3.33Å; K356-E359 PolarHBondContact O-N 3.26Å; K356-K360 WeakPolarHBondContact O-CB 3.35Å; K356-K360 PolarHBondContact O-N 3.45Å
357	E	45.9	Very low	42.4	Very low	100 Å²	100	95.9 Å²	95.9	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-74.6	-37.3	-179.4	-132	60.6	-161.6	0	0	111.8	P353 I354 L355 K360 V361	P353-E357 PolarHBondContact O-N 2.86Å; P353-E357 VanDerWaalsContact O-N 3.08Å; I354-E357 PolarHBondContact O-N 2.81Å; L355-E357 VanDerWaalsContact C-N 3.31Å; L355-E357 PolarHBondContact O-N 3.35Å; E357-K360 WeakPolarHBondContact O-CB 3.45Å; E357-K360 PolarHBondContact O-N 2.77Å; E357-K360 WeakPolarHBondContact OE1-CD 3.26Å; E357-K360 IonicContact OE1-NZ 2.68Å; E357-K360 PolarHBondContact OE1-NZ 3.29Å; E357-K360 VanDerWaalsContact OE1-NZ 3.08Å; E357-K360 IonicContact OE2-NZ 3.63Å; E357-V361 WeakPolarHBondContact O-CG2 3.28Å; E357-V361 PolarHBondContact O-N 3.33Å
358	I	43.4	Very low	43.8	Very low	63 Å²	63	93.7 Å²	93.7	32%	0.323	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-44.7	171	-62.9	171.1	0	0	0	110.3	I354 L355 K360 V361 A362	I354-I358 PolarHBondContact O-N 3.13Å; L355-I358 PolarHBondContact O-N 2.91Å; I358-K360 VanDerWaalsContact C-N 3.34Å; I358-K360 PolarHBondContact O-N 3.42Å; I358-V361 PolarHBondContact O-N 3.22Å; I358-A362 WeakPolarHBondContact O-CB 3.39Å; I358-A362 PolarHBondContact O-N 3.45Å
359	E	47.9	Very low	45.3	Very low	104 Å²	104	95.8 Å²	95.8	49%	0.486	52%	0.524	S	S	.	.	H	α-helix	trans	-60.7	-43.1	174.2	-81	178.7	166.1	0	0	110.9	L355 K356 V361 A362 S363	L355-E359 WeakPolarHBondContact O-CB 3.07Å; L355-E359 WeakPolarHBondContact O-CG 3.34Å; L355-E359 PolarHBondContact O-N 3.04Å; K356-E359 PolarHBondContact O-N 3.26Å; E359-V361 PolarHBondContact O-N 3.32Å; E359-A362 CarbonylContact O-C 3.59Å; E359-A362 PolarHBondContact O-N 2.93Å; E359-S363 WeakPolarHBondContact O-CB 3.27Å; E359-S363 PolarHBondContact O-N 3.27Å; E359-S363 PolarHBondContact O-OG 3.13Å
360	K	54.2	Low	46.4	Very low	133 Å²	133	87.1 Å²	87.1	58%	0.578	49%	0.494	S	S	*	.	H	α-helix	trans	-58.7	-44.9	177.8	-128.4	179.4	-176.8	177.9	0	112.5	K356 E357 I358 S363 N364	K356-K360 WeakPolarHBondContact O-CB 3.35Å; K356-K360 PolarHBondContact O-N 3.45Å; E357-K360 WeakPolarHBondContact O-CB 3.45Å; E357-K360 PolarHBondContact O-N 2.77Å; E357-K360 WeakPolarHBondContact OE1-CD 3.26Å; E357-K360 IonicContact OE1-NZ 2.68Å; E357-K360 PolarHBondContact OE1-NZ 3.29Å; E357-K360 VanDerWaalsContact OE1-NZ 3.08Å; E357-K360 IonicContact OE2-NZ 3.63Å; I358-K360 VanDerWaalsContact C-N 3.34Å; I358-K360 PolarHBondContact O-N 3.42Å; K360-S363 PolarHBondContact O-N 3.13Å; K360-N364 PolarHBondContact O-N 2.96Å
361	V	53.6	Low	47.4	Very low	32 Å²	32	86.8 Å²	86.8	19%	0.194	48%	0.48	C	S	.	.	H	α-helix	trans	-65.6	-46.7	176.6	174.9	0	0	0	0	109.6	E357 I358 E359 S363 N364 L367 E378 A382	E357-V361 WeakPolarHBondContact O-CG2 3.28Å; E357-V361 PolarHBondContact O-N 3.33Å; I358-V361 PolarHBondContact O-N 3.22Å; E359-V361 PolarHBondContact O-N 3.32Å; V361-S363 PolarHBondContact O-N 2.88Å; V361-N364 PolarHBondContact O-N 3.27Å; V361-L367 HydrophobicContact CG1-CD2 4.5Å; V361-L367 VanDerWaalsContact O-CD1 3.31Å; V361-L367 WeakPolarHBondContact O-CD1 3.47Å; V361-E378 HydrophobicContact CG1-CB 4.25Å; V361-A382 HydrophobicContact CG2-CB 4.28Å
362	A	54.3	Low	48.2	Very low	63 Å²	63	88.4 Å²	88.4	52%	0.521	49%	0.489	S	S	.	.	H	α-helix	trans	-63	-27.3	176.5	0	0	0	0	0	113.3	I358 E359 F379	I358-A362 WeakPolarHBondContact O-CB 3.39Å; I358-A362 PolarHBondContact O-N 3.45Å; E359-A362 CarbonylContact O-C 3.59Å; E359-A362 PolarHBondContact O-N 2.93Å; A362-F379 HydrophobicContact CB-CZ 4.45Å
363	S	52.2	Low	48.9	Very low	87 Å²	87	94 Å²	94	61%	0.608	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.8	-178	-55.9	0	0	0	0	113.7	E359 K360 V361 P365	E359-S363 WeakPolarHBondContact O-CB 3.27Å; E359-S363 PolarHBondContact O-N 3.27Å; E359-S363 PolarHBondContact O-OG 3.13Å; K360-S363 PolarHBondContact O-N 3.13Å; V361-S363 PolarHBondContact O-N 2.88Å; S363-P365 WeakPolarHBondContact O-CD 3.49Å
364	N	55.2	Low	49.5	Very low	66 Å²	66	90.9 Å²	90.9	35%	0.353	49%	0.491	S	S	.	.			trans	-74.6	108	-176	-170	2.3	0	0	0	109.2	K360 V361 N366 L367	K360-N364 PolarHBondContact O-N 2.96Å; V361-N364 PolarHBondContact O-N 3.27Å; N364-N366 PolarHBondContact O-N 3.13Å; N364-L367 HydrophobicContact CB-CD1 3.73Å; N364-L367 PolarHBondContact O-N 2.95Å
365	P	50.9	Low	50	Low	98 Å²	98	88.3 Å²	88.3	64%	0.636	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-64.8	-18.3	-169.3	26.1	-34.1	0	0	0	112.9	S363 L367	S363-P365 WeakPolarHBondContact O-CD 3.49Å; P365-L367 VanDerWaalsContact C-N 3.27Å; P365-L367 PolarHBondContact O-N 3.36Å
366	N	58.4	Low	50.7	Low	102 Å²	102	87.9 Å²	87.9	55%	0.545	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-72.7	-14.8	176.8	-68.5	-26.8	0	0	0	113.6	N364 I368 N369	N364-N366 PolarHBondContact O-N 3.13Å; N366-I368 VanDerWaalsContact C-N 3.25Å; N366-I368 PolarHBondContact O-N 2.9Å; N366-N369 PolarHBondContact O-N 3.49Å
367	L	48.5	Very low	50.9	Low	14 Å²	14	84.7 Å²	84.7	7%	0.073	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-60.6	-36.4	177	-101.9	92.9	0	0	0	111.7	V361 N364 P365 N369 Q370 Q375 E378 F379	V361-L367 HydrophobicContact CG1-CD2 4.5Å; V361-L367 VanDerWaalsContact O-CD1 3.31Å; V361-L367 WeakPolarHBondContact O-CD1 3.47Å; N364-L367 HydrophobicContact CB-CD1 3.73Å; N364-L367 PolarHBondContact O-N 2.95Å; P365-L367 VanDerWaalsContact C-N 3.27Å; P365-L367 PolarHBondContact O-N 3.36Å; L367-N369 PolarHBondContact O-N 3.29Å; L367-Q370 WeakPolarHBondContact O-CB 3.5Å; L367-Q370 PolarHBondContact O-N 3.22Å; L367-Q370 VanDerWaalsContact O-N 3.08Å; L367-Q375 HydrophobicContact CD2-CB 4.37Å; L367-Q375 HydrophobicContact CD2-CG 4.31Å; L367-Q375 WeakPolarHBondContact O-CG 3.42Å; L367-Q375 PolarHBondContact O-NE2 3.1Å; L367-E378 VanDerWaalsContact CD1-OE2 3.31Å; L367-E378 WeakPolarHBondContact CD1-OE2 3.07Å; L367-F379 HydrophobicContact CD2-CD2 4.35Å; L367-F379 HydrophobicContact CD2-CE2 4.19Å
368	I	52.8	Low	51.1	Low	140 Å²	140	83 Å²	83	72%	0.718	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-63.6	-30.9	-175.3	-63.2	171.8	0	0	0	111.7	N366 Q370	N366-I368 VanDerWaalsContact C-N 3.25Å; N366-I368 PolarHBondContact O-N 2.9Å; I368-Q370 VanDerWaalsContact C-N 3.32Å
369	N	57	Low	51.2	Low	143 Å²	143	84.2 Å²	84.2	77%	0.765	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-88.8	-0.7	-179.7	-67.7	-20.9	0	0	0	113.5	N366 L367	N366-N369 PolarHBondContact O-N 3.49Å; L367-N369 PolarHBondContact O-N 3.29Å
370	Q	47.9	Very low	51.3	Low	73 Å²	73	84.5 Å²	84.5	34%	0.341	47%	0.47	S	S	.	.	S	Bend	trans	-92.2	152.1	178.4	-77.2	-168.3	22.7	0	0	112.1	L367 I368 S374 Q375	L367-Q370 WeakPolarHBondContact O-CB 3.5Å; L367-Q370 PolarHBondContact O-N 3.22Å; L367-Q370 VanDerWaalsContact O-N 3.08Å; I368-Q370 VanDerWaalsContact C-N 3.32Å; Q370-S374 WeakPolarHBondContact CB-OG 3.48Å; Q370-S374 PolarHBondContact OE1-OG 3.33Å; Q370-Q375 HydrophobicContact CB-CG 4.36Å; Q370-Q375 PolarHBondContact O-NE2 3.09Å
371	S	48.4	Very low	51	Low	66 Å²	66	85.7 Å²	85.7	46%	0.462	48%	0.477	S	S	.	.			trans	-58.1	146.6	175.5	68.1	0	0	0	0	111.4	Q373 S374 Q375	S371-Q373 PolarHBondContact O-N 3.43Å; S371-S374 PolarHBondContact O-N 3.5Å; S371-S374 PolarHBondContact O-OG 2.77Å; S371-S374 PolarHBondContact OG-OG 2.87Å; S371-Q375 PolarHBondContact O-N 2.82Å
372	P	46.1	Very low	50.3	Low	93 Å²	93	85.7 Å²	85.7	60%	0.604	48%	0.48	S	S	*	.	H	α-helix	trans	-55.2	-30.1	-178.2	-24.3	31.7	0	0	0	113.5	V376	P372-V376 WeakPolarHBondContact O-CB 3.42Å; P372-V376 WeakPolarHBondContact O-CG2 3.38Å; P372-V376 PolarHBondContact O-N 3.29Å; P372-V376 VanDerWaalsContact O-N 3.1Å
373	Q	48.3	Very low	49.3	Very low	167 Å²	167	89.2 Å²	89.2	78%	0.78	49%	0.488	S	S	*	.	H	α-helix	trans	-69.7	-35.7	179.6	-69.7	168.9	-5.7	0	0	112.5	S371 S377	S371-Q373 PolarHBondContact O-N 3.43Å; Q373-S377 PolarHBondContact O-N 2.68Å; Q373-S377 VanDerWaalsContact O-N 3.11Å
374	S	52.9	Low	48.3	Very low	37 Å²	37	89.8 Å²	89.8	26%	0.259	49%	0.489	S	S	.	.	H	α-helix	trans	-79.7	-34	176.6	64.8	0	0	0	0	112.2	Q370 S371 V376 S377 E378	Q370-S374 WeakPolarHBondContact CB-OG 3.48Å; Q370-S374 PolarHBondContact OE1-OG 3.33Å; S371-S374 PolarHBondContact O-N 3.5Å; S371-S374 PolarHBondContact O-OG 2.77Å; S371-S374 PolarHBondContact OG-OG 2.87Å; S374-V376 VanDerWaalsContact C-N 3.29Å; S374-V376 PolarHBondContact O-N 3.3Å; S374-S377 WeakPolarHBondContact O-CB 3.46Å; S374-S377 PolarHBondContact O-N 2.89Å; S374-E378 PolarHBondContact O-N 3.13Å
375	Q	49.1	Very low	47.3	Very low	60 Å²	60	92.6 Å²	92.6	28%	0.28	51%	0.509	S	S	.	.	H	α-helix	trans	-56	-45.2	169.8	-68.5	176.9	-13.5	0	0	111.2	L367 Q370 S371 F379	L367-Q375 HydrophobicContact CD2-CB 4.37Å; L367-Q375 HydrophobicContact CD2-CG 4.31Å; L367-Q375 WeakPolarHBondContact O-CG 3.42Å; L367-Q375 PolarHBondContact O-NE2 3.1Å; Q370-Q375 HydrophobicContact CB-CG 4.36Å; Q370-Q375 PolarHBondContact O-NE2 3.09Å; S371-Q375 PolarHBondContact O-N 2.82Å; Q375-F379 PolarHBondContact O-N 3.04Å; Q375-F379 VanDerWaalsContact O-N 3.13Å
376	V	50.5	Low	46.3	Very low	81 Å²	81	96 Å²	96	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-67.8	-38.3	178	172.4	0	0	0	0	111.4	P372 S374 F379 I380	P372-V376 WeakPolarHBondContact O-CB 3.42Å; P372-V376 WeakPolarHBondContact O-CG2 3.38Å; P372-V376 PolarHBondContact O-N 3.29Å; P372-V376 VanDerWaalsContact O-N 3.1Å; S374-V376 VanDerWaalsContact C-N 3.29Å; S374-V376 PolarHBondContact O-N 3.3Å; V376-F379 PolarHBondContact O-N 3.14Å; V376-I380 HydrophobicContact CG1-CD1 3.56Å; V376-I380 HydrophobicContact CG1-CG1 4.17Å; V376-I380 WeakPolarHBondContact O-CB 3.41Å; V376-I380 WeakPolarHBondContact O-CG1 3.22Å; V376-I380 PolarHBondContact O-N 3.13Å
377	S	51.9	Low	44.6	Very low	57 Å²	57	97.8 Å²	97.8	40%	0.399	53%	0.53	S	S	.	.	H	α-helix	trans	-59.2	-48.1	175.2	167.1	0	0	0	0	112.5	Q373 S374 I380 Q381	Q373-S377 PolarHBondContact O-N 2.68Å; Q373-S377 VanDerWaalsContact O-N 3.11Å; S374-S377 WeakPolarHBondContact O-CB 3.46Å; S374-S377 PolarHBondContact O-N 2.89Å; S377-I380 PolarHBondContact O-N 2.9Å; S377-Q381 WeakPolarHBondContact O-CG 3.27Å; S377-Q381 PolarHBondContact O-N 2.9Å
378	E	50.5	Low	43.5	Very low	65 Å²	65	102.5 Å²	102.5	30%	0.304	56%	0.564	S	S	.	*	H	α-helix	trans	-65.3	-38.8	177.5	-88.2	-175.3	152.3	0	0	111.9	V361 L367 S374 Q381 A382	V361-E378 HydrophobicContact CG1-CB 4.25Å; L367-E378 VanDerWaalsContact CD1-OE2 3.31Å; L367-E378 WeakPolarHBondContact CD1-OE2 3.07Å; S374-E378 PolarHBondContact O-N 3.13Å; E378-Q381 PolarHBondContact O-N 2.72Å; E378-A382 PolarHBondContact O-N 3.45Å
379	F	45.4	Very low	42	Very low	87 Å²	87	106.4 Å²	106.4	38%	0.382	57%	0.57	S	S	.	*	H	α-helix	trans	-64.3	-38.7	174.3	-101.5	-83.9	0	0	0	113.1	A362 L367 Q375 V376 A382 M383	A362-F379 HydrophobicContact CB-CZ 4.45Å; L367-F379 HydrophobicContact CD2-CD2 4.35Å; L367-F379 HydrophobicContact CD2-CE2 4.19Å; Q375-F379 PolarHBondContact O-N 3.04Å; Q375-F379 VanDerWaalsContact O-N 3.13Å; V376-F379 PolarHBondContact O-N 3.14Å; F379-A382 PolarHBondContact O-N 2.93Å; F379-M383 PolarHBondContact O-N 2.8Å
380	I	49	Very low	40.4	Very low	111 Å²	111	106 Å²	106	57%	0.569	58%	0.576	S	S	*	*	H	α-helix	trans	-68.2	-40	177.1	-70	168.2	0	0	0	110.5	V376 S377 A382 M383	V376-I380 HydrophobicContact CG1-CD1 3.56Å; V376-I380 HydrophobicContact CG1-CG1 4.17Å; V376-I380 WeakPolarHBondContact O-CB 3.41Å; V376-I380 WeakPolarHBondContact O-CG1 3.22Å; V376-I380 PolarHBondContact O-N 3.13Å; S377-I380 PolarHBondContact O-N 2.9Å; I380-A382 PolarHBondContact O-N 3.43Å; I380-M383 PolarHBondContact O-N 2.95Å; I380-M383 VanDerWaalsContact O-N 3.15Å
381	Q	48.7	Very low	39.2	Very low	158 Å²	158	107.9 Å²	107.9	74%	0.738	59%	0.593	S	S	*	*	H	α-helix	trans	-65.8	-27.6	175.3	-72.6	-175.2	8	0	0	112.8	S377 E378 M383	S377-Q381 WeakPolarHBondContact O-CG 3.27Å; S377-Q381 PolarHBondContact O-N 2.9Å; E378-Q381 PolarHBondContact O-N 2.72Å; Q381-M383 VanDerWaalsContact C-N 3.3Å
382	A	37.7	Very low	37.9	Very low	31 Å²	31	112.9 Å²	112.9	26%	0.256	61%	0.611	S	S	.	*	H	α-helix	trans	-76.9	-14.2	175	0	0	0	0	0	113.6	V361 E378 F379 I380	V361-A382 HydrophobicContact CG2-CB 4.28Å; E378-A382 PolarHBondContact O-N 3.45Å; F379-A382 PolarHBondContact O-N 2.93Å; I380-A382 PolarHBondContact O-N 3.43Å
383	M	33.8	Very low	36.9	Very low	138 Å²	138	114.4 Å²	114.4	68%	0.68	62%	0.619	S	S	*	*	S	Bend	trans	-82.9	122.5	172.6	-73	-157.4	178.7	0	0	110.2	F379 I380 Q381 V385	F379-M383 PolarHBondContact O-N 2.8Å; I380-M383 PolarHBondContact O-N 2.95Å; I380-M383 VanDerWaalsContact O-N 3.15Å; Q381-M383 VanDerWaalsContact C-N 3.3Å; M383-V385 PolarHBondContact O-N 3.2Å
384	P	31.8	Very low	35.6	Very low	99 Å²	99	115.6 Å²	115.6	64%	0.643	62%	0.622	S	S	*	*			trans	-64.3	130.9	176	25.9	-31.1	0	0	0	109.5	L386	P384-L386 PolarHBondContact O-N 3.33Å
385	V	33.7	Very low	34.1	Very low	125 Å²	125	125.2 Å²	125.2	76%	0.758	65%	0.652	S	S	*	*			trans	-57.3	105.6	163	-174.2	0	0	0	0	106	M383 N387	M383-V385 PolarHBondContact O-N 3.2Å; V385-N387 PolarHBondContact O-N 2.82Å
386	L	29.2	Very low	33	Very low	168 Å²	168	129.4 Å²	129.4	88%	0.88	67%	0.672	S	S	*	*			trans	-61.2	86.2	169.8	-88.9	157.3	0	0	0	107.2	P384 S388	P384-L386 PolarHBondContact O-N 3.33Å; L386-S388 PolarHBondContact O-N 3.38Å
387	N	23.8	Very low	31.9	Very low	141 Å²	141	132.8 Å²	132.8	75%	0.754	69%	0.686	S	S	*	*			trans	-60.5	105.9	167.5	-97.7	-17.4	0	0	0	106.3	V385 R389	V385-N387 PolarHBondContact O-N 2.82Å; N387-R389 PolarHBondContact O-N 3.21Å
388	S	25.4	Very low	30.7	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	71%	0.707	S	S	*	*	S	Bend	trans	-59.8	77.5	175.7	43.4	0	0	0	0	110.9	L386	L386-S388 PolarHBondContact O-N 3.38Å
389	R	22	Very low	29.4	Very low	222 Å²	222	135.8 Å²	135.8	84%	0.838	72%	0.722	S	S	*	*			trans	-166.6	70.4	178.7	-110.9	176.6	-117.7	-156.2	0.2	112.2	N387	N387-R389 PolarHBondContact O-N 3.21Å
390	C	22.6	Very low	28.3	Very low	133 Å²	133	139 Å²	139	90%	0.899	74%	0.744	S	S	*	*			trans	-109.8	84.2	158.3	-107.1	0	0	0	0	108.5	M392	C390-M392 PolarHBondContact O-N 2.84Å
391	T	22.3	Very low	27	Very low	114 Å²	114	139.7 Å²	139.7	70%	0.699	75%	0.753	S	S	*	*			trans	-68.9	99.2	167.2	46.6	0	0	0	0	108.5	T393	T391-T393 PolarHBondContact O-N 2.73Å; T391-T393 VanDerWaalsContact O-N 3.13Å
392	M	22.3	Very low	25.7	Very low	170 Å²	170	135.4 Å²	135.4	84%	0.837	75%	0.751	S	S	*	*			trans	-79.9	88.9	166.3	-88.9	-150.4	71	0	0	109.4	C390 K394	C390-M392 PolarHBondContact O-N 2.84Å; M392-K394 PolarHBondContact O-N 3.46Å
393	T	23.4	Very low	25	Very low	125 Å²	125	139.3 Å²	139.3	77%	0.767	78%	0.776	S	S	*	*			trans	-76.1	103.4	166.8	47	0	0	0	0	109.1	T391	T391-T393 PolarHBondContact O-N 2.73Å; T391-T393 VanDerWaalsContact O-N 3.13Å
394	K	21.8	Very low	24.3	Very low	192 Å²	192	140.1 Å²	140.1	84%	0.835	78%	0.782	S	S	*	*			trans	-95.1	115.5	168.2	-137.3	176.2	-174.9	-179.2	0	108.1	M392 H396	M392-K394 PolarHBondContact O-N 3.46Å; K394-H396 PolarHBondContact O-N 3.34Å
395	R	21.7	Very low	23.8	Very low	239 Å²	239	141.8 Å²	141.8	90%	0.902	79%	0.79	S	S	*	*			trans	-72.9	117.8	175.6	-88.1	-179.7	176.6	155.7	-1.4	109.4
396	H	25.2	Very low	23.2	Very low	148 Å²	148	144.1 Å²	144.1	69%	0.685	79%	0.793	S	S	*	*	B	Isolated β-bridge	trans	-124.5	118.3	161.6	-156.9	63.3	0	0	0	108	K394 G398	K394-H396 PolarHBondContact O-N 3.34Å; H396-G398 PolarHBondContact O-N 2.9Å; H396-G398 VanDerWaalsContact O-N 3.16Å
397	L	27.6	Very low	22.8	Very low	152 Å²	152	140.8 Å²	140.8	80%	0.796	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	52	39.7	168.5	-59.1	171.5	0	0	0	116.8	V399	L397-V399 VanDerWaalsContact C-N 3.29Å; L397-V399 PolarHBondContact O-N 3.43Å
398	G	27.4	Very low	22.7	Very low	81 Å²	81	140.3 Å²	140.3	84%	0.835	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.6	7.4	167.5	0	0	0	0	0	116.2	H396	H396-G398 PolarHBondContact O-N 2.9Å; H396-G398 VanDerWaalsContact O-N 3.16Å
399	V	23.1	Very low	22.5	Very low	104 Å²	104	139.4 Å²	139.4	63%	0.63	78%	0.778	S	S	*	*	B	Isolated β-bridge	trans	-116.9	126.2	178.7	-175.1	0	0	0	0	110.6	L397 V401	L397-V399 VanDerWaalsContact C-N 3.29Å; L397-V399 PolarHBondContact O-N 3.43Å; V399-V401 PolarHBondContact O-N 2.75Å
400	N	22.1	Very low	22.6	Very low	155 Å²	155	136.7 Å²	136.7	83%	0.829	77%	0.772	S	S	*	*			trans	-77.3	109.3	177.9	-74.2	-33.1	0	0	0	110.2
401	V	21.5	Very low	22.6	Very low	125 Å²	125	140.2 Å²	140.2	76%	0.758	77%	0.767	S	S	*	*			trans	-105.7	98.4	169.4	-170.6	0	0	0	0	108	V399	V399-V401 PolarHBondContact O-N 2.75Å
402	G	21.2	Very low	22.5	Very low	69 Å²	69	140.5 Å²	140.5	71%	0.711	77%	0.773	S	S	*	*			trans	-90.9	108.6	176.3	0	0	0	0	0	110.6	L404	G402-L404 PolarHBondContact O-N 3.46Å
403	C	22.8	Very low	22.6	Very low	113 Å²	113	139.2 Å²	139.2	76%	0.764	77%	0.765	S	S	*	*			trans	-82.8	95.4	174.2	-41.9	0	0	0	0	109	T405	C403-T405 PolarHBondContact O-N 3.35Å
404	L	19.9	Very low	22.5	Very low	155 Å²	155	137.2 Å²	137.2	81%	0.812	77%	0.77	S	S	*	*			trans	-72.7	102.9	168.9	-75.3	158.3	0	0	0	108.8	G402	G402-L404 PolarHBondContact O-N 3.46Å
405	T	22	Very low	22.5	Very low	134 Å²	134	133.7 Å²	133.7	82%	0.822	76%	0.764	S	S	*	*			trans	-98.9	87.4	162.9	50.3	0	0	0	0	108.5	C403 S407	C403-T405 PolarHBondContact O-N 3.35Å; T405-S407 PolarHBondContact O-N 3.02Å; T405-S407 VanDerWaalsContact O-N 3.08Å
406	E	21.1	Very low	22.6	Very low	174 Å²	174	127.6 Å²	127.6	81%	0.813	76%	0.758	S	S	*	*			trans	-61	107	165.3	-66.2	-178.3	164	0	0	108.1	P408	E406-P408 WeakPolarHBondContact O-CD 3.47Å
407	S	20.2	Very low	22.6	Very low	97 Å²	97	126.6 Å²	126.6	68%	0.678	77%	0.765	S	S	*	*			trans	-87.1	115.9	162.4	62	0	0	0	0	107.5	T405 V409	T405-S407 PolarHBondContact O-N 3.02Å; T405-S407 VanDerWaalsContact O-N 3.08Å; S407-V409 WeakPolarHBondContact O-CG2 3.42Å; S407-V409 PolarHBondContact O-N 3.33Å; S407-V409 VanDerWaalsContact O-N 3.09Å
408	P	22.4	Very low	22.3	Very low	132 Å²	132	129.1 Å²	129.1	86%	0.857	77%	0.769	S	S	*	*			trans	-69.1	111.2	174.1	24.9	-28.9	0	0	0	108.3	E406	E406-P408 WeakPolarHBondContact O-CD 3.47Å
409	V	20.9	Very low	22.1	Very low	94 Å²	94	134.3 Å²	134.3	57%	0.57	77%	0.769	S	S	*	*			trans	-78.7	148.8	178.3	-155.3	0	0	0	0	109.9	S407	S407-V409 WeakPolarHBondContact O-CG2 3.42Å; S407-V409 PolarHBondContact O-N 3.33Å; S407-V409 VanDerWaalsContact O-N 3.09Å
410	F	23	Very low	22.2	Very low	165 Å²	165	136.4 Å²	136.4	72%	0.724	78%	0.777	S	S	*	*			trans	81	112	154.8	-62.9	-58.3	0	0	0	118.9
411	R	22	Very low	22.1	Very low	207 Å²	207	137.5 Å²	137.5	78%	0.781	78%	0.782	S	S	*	*				153.5	115.8	82.9	-110.5	159.4	-170	160	1.9	109.8	Q413	R411-Q413 PolarHBondContact O-N 3.4Å; R411-Q413 VanDerWaalsContact O-N 3.14Å
412	S	21.4	Very low	22.1	Very low	119 Å²	119	140.8 Å²	140.8	83%	0.832	79%	0.786	S	S	*	*			trans	-62.5	104.3	155	55.1	0	0	0	0	108.9
413	Q	24.3	Very low	22	Very low	144 Å²	144	142.6 Å²	142.6	67%	0.673	79%	0.787	S	S	*	*			trans	-134.8	100.2	162.2	-76.4	-72.1	-20.9	0	0	106.7	R411 T415	R411-Q413 PolarHBondContact O-N 3.4Å; R411-Q413 VanDerWaalsContact O-N 3.14Å; Q413-T415 VanDerWaalsContact C-N 3.34Å; Q413-T415 PolarHBondContact O-N 3.2Å; Q413-T415 VanDerWaalsContact O-N 3.08Å
414	G	21.5	Very low	21.9	Very low	83 Å²	83	145.6 Å²	145.6	86%	0.856	79%	0.788	S	S	*	*			trans	-67.2	98.1	160.5	0	0	0	0	0	108
415	T	21.3	Very low	22	Very low	117 Å²	117	144.4 Å²	144.4	72%	0.718	79%	0.787	S	S	*	*			trans	-145.2	122	157.6	46.6	0	0	0	0	108.6	Q413	Q413-T415 VanDerWaalsContact C-N 3.34Å; Q413-T415 PolarHBondContact O-N 3.2Å; Q413-T415 VanDerWaalsContact O-N 3.08Å
416	S	23.9	Very low	21.9	Very low	111 Å²	111	144 Å²	144	78%	0.776	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-57.2	163	177	45.9	0	0	0	0	113.4
417	P	24.9	Very low	21.9	Very low	127 Å²	127	141.6 Å²	141.6	83%	0.825	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-87	126.4	-150.5	33.5	-31.3	0	0	0	111.7
418	K	21.9	Very low	21.8	Very low	206 Å²	206	140.4 Å²	140.4	90%	0.896	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-102.9	123.6	161.3	-84.6	-174.8	174.9	-179.9	0	109.3
419	K	22.3	Very low	21.8	Very low	189 Å²	189	139.9 Å²	139.9	82%	0.822	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-57.7	153.6	166.8	-69.9	175.9	173.5	179.2	0	109.8
420	D	25	Very low	21.7	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	79%	0.794	S	S	*	*			trans	83.3	73.5	163.3	-48.8	-32.4	0	0	0	117.4
421	L	21.6	Very low	21.6	Very low	178 Å²	178	146 Å²	146	93%	0.932	80%	0.8	S	S	*	*			trans	-144.2	113.1	144.4	-106.9	117.9	0	0	0	111	S423	L421-S423 PolarHBondContact O-N 3.16Å
422	K	20.3	Very low	21.5	Very low	194 Å²	194	144 Å²	144	84%	0.843	80%	0.799	S	S	*	*			trans	-73.5	101.6	167.7	-69	176.7	177.3	178.7	0	108.1
423	S	20.1	Very low	21.6	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	79%	0.791	S	S	*	*			trans	-90.9	110.4	163.9	64.3	0	0	0	0	109.1	L421 T425	L421-S423 PolarHBondContact O-N 3.16Å; S423-T425 PolarHBondContact O-N 3.01Å
424	F	20.6	Very low	21.4	Very low	175 Å²	175	143.4 Å²	143.4	77%	0.768	80%	0.799	S	S	*	*			trans	-61.8	119.7	165.8	-76.8	-103	0	0	0	110.1
425	T	20.4	Very low	21.5	Very low	130 Å²	130	145.2 Å²	145.2	80%	0.798	79%	0.793	S	S	*	*			trans	-145.2	75.6	148.1	36.4	0	0	0	0	107.8	S423 C427	S423-T425 PolarHBondContact O-N 3.01Å; T425-C427 PolarHBondContact O-N 2.85Å
426	T	20.4	Very low	21.5	Very low	125 Å²	125	148.5 Å²	148.5	77%	0.767	80%	0.8	S	S	*	*			trans	-70.6	96.5	161.6	41.5	0	0	0	0	108.5
427	C	21	Very low	21.3	Very low	125 Å²	125	150.2 Å²	150.2	85%	0.845	80%	0.8	S	S	*	*			trans	-87.4	98.5	152.5	-66.5	0	0	0	0	106	T425	T425-C427 PolarHBondContact O-N 2.85Å
428	G	19.4	Very low	21.1	Very low	71 Å²	71	149.4 Å²	149.4	73%	0.732	79%	0.792	S	S	*	*			trans	-67	133.1	178.6	0	0	0	0	0	111.1
429	V	20.9	Very low	21	Very low	121 Å²	121	148.7 Å²	148.7	73%	0.733	79%	0.792	S	S	*	*			trans	-116.4	106.9	151.2	-179.2	0	0	0	0	104.7	Y431	V429-Y431 PolarHBondContact O-N 3.24Å
430	Q	19.9	Very low	20.9	Very low	172 Å²	172	150.8 Å²	150.8	80%	0.804	79%	0.794	S	S	*	*			trans	-60.7	124.5	175.2	-79.2	164.9	-78.6	0	0	109.2
431	Y	19.5	Very low	20.8	Very low	217 Å²	217	147.2 Å²	147.2	85%	0.851	79%	0.793	S	S	*	*			trans	-101.9	108	152.3	-83.3	-86.8	0	0	0	106.9	V429 S433	V429-Y431 PolarHBondContact O-N 3.24Å; Y431-S433 PolarHBondContact O-N 3.47Å
432	E	21.5	Very low	20.8	Very low	163 Å²	163	145 Å²	145	76%	0.762	79%	0.791	S	S	*	*			trans	-69.6	119.7	166.9	-77.3	-177.1	151.6	0	0	109.4
433	S	22.6	Very low	20.9	Very low	96 Å²	96	143.2 Å²	143.2	67%	0.671	79%	0.79	S	S	*	*			trans	28.9	117.1	146.9	56.6	0	0	0	0	121	Y431	Y431-S433 PolarHBondContact O-N 3.47Å
434	N	20.9	Very low	21.3	Very low	155 Å²	155	143.5 Å²	143.5	83%	0.829	79%	0.79	S	S	*	*			trans	42.2	99.1	131.5	-62.5	-4.4	0	0	0	119.2
435	V	23.5	Very low	21.4	Very low	122 Å²	122	143.2 Å²	143.2	74%	0.739	80%	0.795	S	S	*	*			trans	-121.4	103.2	145.1	-177.8	0	0	0	0	108.1	L437	V435-L437 HydrophobicContact CG1-CD1 3.75Å; V435-L437 HydrophobicContact CG1-CG 3.93Å; V435-L437 PolarHBondContact O-N 2.9Å
436	E	20.1	Very low	21.5	Very low	185 Å²	185	141.4 Å²	141.4	86%	0.864	79%	0.786	S	S	*	*			trans	-66.7	105.3	161.8	-67.8	177.4	159.7	0	0	108.2
437	L	21.3	Very low	21.7	Very low	148 Å²	148	141 Å²	141	78%	0.775	79%	0.786	S	S	*	*			trans	-118.2	88.7	166.4	-95.1	162	0	0	0	109.8	V435	V435-L437 HydrophobicContact CG1-CD1 3.75Å; V435-L437 HydrophobicContact CG1-CG 3.93Å; V435-L437 PolarHBondContact O-N 2.9Å
438	V	20.2	Very low	21.9	Very low	110 Å²	110	140 Å²	140	67%	0.667	77%	0.769	S	S	*	*			trans	41.1	95.5	136.9	-167.8	0	0	0	0	116.7	R440	V438-R440 VanDerWaalsContact C-N 3.35Å; V438-R440 HydrophobicContact CG1-CB 4.14Å; V438-R440 HydrophobicContact CG1-CG 4.2Å; V438-R440 PolarHBondContact O-N 3.38Å
439	H	20.1	Very low	22.1	Very low	190 Å²	190	144 Å²	144	88%	0.88	77%	0.773	S	S	*	*			trans	-59.7	82.8	156.1	-151	-71.3	0	0	0	110.9
440	R	20.4	Very low	22.2	Very low	233 Å²	233	147.2 Å²	147.2	88%	0.879	78%	0.777	S	S	*	*			trans	-148.6	112.2	164.8	-82.3	-164	178.8	163.9	0.8	111.8	V438	V438-R440 VanDerWaalsContact C-N 3.35Å; V438-R440 HydrophobicContact CG1-CB 4.14Å; V438-R440 HydrophobicContact CG1-CG 4.2Å; V438-R440 PolarHBondContact O-N 3.38Å
441	G	21.8	Very low	22.4	Very low	74 Å²	74	147 Å²	147	76%	0.763	77%	0.769	S	S	*	*	S	Bend	trans	121.9	86.6	161.6	0	0	0	0	0	112.4
442	C	21	Very low	22.7	Very low	132 Å²	132	142.6 Å²	142.6	89%	0.892	76%	0.758	S	S	*	*			trans	143.3	73.9	143.6	-69.7	0	0	0	0	110.8
443	D	23.3	Very low	22.8	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	76%	0.758	S	S	*	*			trans	-117.8	155.6	149.6	-104	-24	0	0	0	107.5
444	P	28.9	Very low	22.9	Very low	113 Å²	113	139.6 Å²	139.6	73%	0.734	76%	0.761	S	S	*	*				-106	147.9	-116.8	35.5	-34.2	0	0	0	114.1	C446	P444-C446 PolarHBondContact O-N 2.98Å; P444-C446 VanDerWaalsContact O-N 3.07Å
445	I	22.3	Very low	23	Very low	169 Å²	169	136.5 Å²	136.5	87%	0.867	75%	0.752	S	S	*	*			trans	-70.2	104.1	168.3	-63.6	173.1	0	0	0	108.7
446	C	22.4	Very low	23	Very low	93 Å²	93	136.7 Å²	136.7	63%	0.628	75%	0.753	S	S	*	*			trans	51.2	114.3	145	-68.3	0	0	0	0	120	P444 E448	P444-C446 PolarHBondContact O-N 2.98Å; P444-C446 VanDerWaalsContact O-N 3.07Å; C446-E448 PolarHBondContact O-N 3.32Å
447	P	24.2	Very low	23	Very low	116 Å²	116	137.3 Å²	137.3	75%	0.753	76%	0.756	S	S	*	*			trans	-68.5	25.7	172.5	-16.3	30.8	0	0	0	117.2	L449 K450	P447-L449 VanDerWaalsContact C-N 3.25Å; P447-L449 PolarHBondContact O-N 2.92Å; P447-L449 VanDerWaalsContact O-N 3.12Å; P447-K450 PolarHBondContact O-N 3.43Å; P447-K450 VanDerWaalsContact O-N 3.15Å
448	E	25.8	Very low	23.1	Very low	105 Å²	105	135.1 Å²	135.1	49%	0.491	75%	0.749	S	S	.	*	G	3₁₀ helix	trans	-70.9	-16.5	-163.4	-151.4	58.3	-156.6	0	0	114.5	C446 R451	C446-E448 PolarHBondContact O-N 3.32Å; E448-R451 IonicContact OE1-NH1 3.9Å
449	L	22.7	Very low	23.1	Very low	155 Å²	155	138.7 Å²	138.7	81%	0.812	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-81.9	-10.7	176.3	-77.8	166.7	0	0	0	114.5	P447	P447-L449 VanDerWaalsContact C-N 3.25Å; P447-L449 PolarHBondContact O-N 2.92Å; P447-L449 VanDerWaalsContact O-N 3.12Å
450	K	23.2	Very low	23.2	Very low	187 Å²	187	138.4 Å²	138.4	81%	0.813	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-87.9	-10.5	175.9	-110.7	-179.1	-179.4	177.7	0	114.2	P447	P447-K450 PolarHBondContact O-N 3.43Å; P447-K450 VanDerWaalsContact O-N 3.15Å
451	R	24.5	Very low	23.2	Very low	169 Å²	169	135.5 Å²	135.5	64%	0.638	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-26.1	178.1	-156.4	179.5	-68.9	155.8	-0.6	113.3	E448 A453	E448-R451 IonicContact OE1-NH1 3.9Å; R451-A453 VanDerWaalsContact C-N 3.31Å; R451-A453 PolarHBondContact O-N 3.06Å
452	I	25.4	Very low	23.1	Very low	123 Å²	123	138.2 Å²	138.2	63%	0.631	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-74.6	-23.8	-177.5	-57.9	176	0	0	0	111.9	S454	I452-S454 PolarHBondContact O-N 3.49Å
453	A	23.7	Very low	23	Very low	93 Å²	93	136.6 Å²	136.6	77%	0.769	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-84.9	5.3	-175.9	0	0	0	0	0	115.8	R451	R451-A453 VanDerWaalsContact C-N 3.31Å; R451-A453 PolarHBondContact O-N 3.06Å
454	S	24.8	Very low	22.9	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-138.1	14	-175.2	57.2	0	0	0	0	117.6	I452	I452-S454 PolarHBondContact O-N 3.49Å
455	S	23.3	Very low	22.5	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	75%	0.753	S	S	*	*			trans	-142.3	60.8	176	69.4	0	0	0	0	114
456	T	23.4	Very low	22.5	Very low	126 Å²	126	137 Å²	137	77%	0.773	74%	0.744	S	S	*	*			trans	-133.9	61.8	159.8	53.2	0	0	0	0	109.8
457	Q	21.1	Very low	22.6	Very low	197 Å²	197	138 Å²	138	92%	0.921	75%	0.747	S	S	*	*			trans	-94.1	82.2	149.8	-88.1	-174.8	-18.6	0	0	106.9
458	T	22.3	Very low	22.5	Very low	103 Å²	103	139.9 Å²	139.9	63%	0.632	75%	0.751	S	S	*	*			trans	-101.1	94	166.9	45.3	0	0	0	0	107.7	F460	T458-F460 PolarHBondContact O-N 3.16Å; T458-F460 VanDerWaalsContact O-N 3.15Å
459	Q	20.3	Very low	22.4	Very low	184 Å²	184	139.3 Å²	139.3	86%	0.86	76%	0.764	S	S	*	*			trans	-62.3	102.6	157.4	-74.8	179.4	-30.6	0	0	107.3	E461	Q459-E461 PolarHBondContact O-N 3.34Å
460	F	22.2	Very low	22.5	Very low	185 Å²	185	137 Å²	137	81%	0.811	76%	0.759	S	S	*	*			trans	-85.5	96.8	162.6	-96.9	-84.8	0	0	0	108	T458 C462	T458-F460 PolarHBondContact O-N 3.16Å; T458-F460 VanDerWaalsContact O-N 3.15Å; F460-C462 PolarHBondContact O-N 3.42Å
461	E	20.5	Very low	22.4	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	76%	0.764	S	S	*	*			trans	-63.5	103.8	159.2	-72.4	-179.1	140.7	0	0	108.6	Q459 S463	Q459-E461 PolarHBondContact O-N 3.34Å; E461-S463 PolarHBondContact O-N 2.98Å
462	C	19.4	Very low	22.4	Very low	131 Å²	131	137.3 Å²	137.3	89%	0.885	77%	0.767	S	S	*	*			trans	-83.9	86.8	163	-92.4	0	0	0	0	108.8	F460	F460-C462 PolarHBondContact O-N 3.42Å
463	S	19.8	Very low	22.2	Very low	98 Å²	98	139.7 Å²	139.7	69%	0.685	77%	0.773	S	S	*	*			trans	-84.1	116.3	169.2	56.4	0	0	0	0	111	E461	E461-S463 PolarHBondContact O-N 2.98Å
464	K	20.7	Very low	22.3	Very low	196 Å²	196	145 Å²	145	85%	0.852	78%	0.779	S	S	*	*			trans	47.9	154.8	136.8	-67.5	179.3	176.6	176.1	0	120.5
465	V	21.6	Very low	22.1	Very low	138 Å²	138	147.4 Å²	147.4	84%	0.836	78%	0.783	S	S	*	*			trans	106.3	119.8	169.8	179.2	0	0	0	0	109.8
466	V	22.2	Very low	22.1	Very low	112 Å²	112	147.6 Å²	147.6	68%	0.679	79%	0.785	S	S	*	*			cis	-171.9	156	14	109.2	0	0	0	0	111
467	T	23.9	Very low	22.1	Very low	114 Å²	114	149 Å²	149	70%	0.699	79%	0.786	S	S	*	*			trans	66	98.7	155.9	55.3	0	0	0	0	122.5
468	D	21.9	Very low	22.1	Very low	156 Å²	156	145.1 Å²	145.1	83%	0.834	78%	0.776	S	S	*	*				23.2	116.8	114.4	-62.7	-32.3	0	0	0	119.9
469	A	22.8	Very low	22.2	Very low	93 Å²	93	149.7 Å²	149.7	77%	0.769	79%	0.787	S	S	*	*			trans	-145.8	104.8	139.8	0	0	0	0	0	109.2
470	P	25.3	Very low	22.4	Very low	107 Å²	107	145.7 Å²	145.7	70%	0.695	78%	0.779	S	S	*	*			trans	-92.4	114.7	-179.5	32.5	-27.2	0	0	0	110.4
471	F	21.7	Very low	22.5	Very low	212 Å²	212	144.3 Å²	144.3	93%	0.93	78%	0.78	S	S	*	*			trans	-100.9	105.5	162.7	-95.7	-82.1	0	0	0	110.3
472	H	24.7	Very low	22.5	Very low	151 Å²	151	147.5 Å²	147.5	70%	0.699	79%	0.785	S	S	*	*			trans	-69.2	141.1	171.2	-90.2	-66.1	0	0	0	112.4
473	K	21.6	Very low	22.6	Very low	173 Å²	173	146.5 Å²	146.5	75%	0.752	78%	0.779	S	S	*	*			trans	49.3	120.3	137.2	-68.4	-178.8	173.1	-179.3	0	118.3
474	K	24.2	Very low	22.9	Very low	205 Å²	205	147.6 Å²	147.6	89%	0.891	78%	0.782	S	S	*	*			trans	-155.1	100.4	131.3	-107.7	168.5	-172.7	-178.1	0	110.3
475	D	21.6	Very low	23	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	78%	0.779	S	S	*	*			trans	-64	136.6	152	-65.1	-53.9	0	0	0	109
476	S	23	Very low	23	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	78%	0.775	S	S	*	*			trans	173.2	109.1	144.3	30.1	0	0	0	0	109.7
477	I	22.4	Very low	23	Very low	156 Å²	156	147.6 Å²	147.6	80%	0.8	78%	0.778	S	S	*	*				87.2	108.8	94.9	-72.5	163.4	0	0	0	112.6
478	V	21.4	Very low	22.9	Very low	115 Å²	115	150.8 Å²	150.8	70%	0.697	79%	0.785	S	S	*	*			trans	63.1	114.4	137.3	-177.4	0	0	0	0	117.7
479	K	25.7	Very low	23	Very low	199 Å²	199	152 Å²	152	87%	0.865	78%	0.783	S	S	*	*				-156	99	123.5	-104.3	165.6	-170	-176.3	0	110
480	S	23	Very low	23	Very low	100 Å²	100	153.2 Å²	153.2	70%	0.699	78%	0.781	S	S	*	*			trans	-64.4	120.7	155.3	51.9	0	0	0	0	108.9
481	N	24.4	Very low	22.8	Very low	156 Å²	156	156.5 Å²	156.5	83%	0.834	79%	0.787	S	S	*	*			trans	-118.7	100.5	153.4	-87.3	-12.8	0	0	0	107.2
482	R	20.7	Very low	22.9	Very low	238 Å²	238	155 Å²	155	90%	0.898	78%	0.78	S	S	*	*			trans	-67.8	125.7	156.2	-85.8	176	167.4	173.1	-5	107.2
483	S	23.1	Very low	22.7	Very low	110 Å²	110	158.6 Å²	158.6	77%	0.769	79%	0.788	S	S	*	*			trans	-133.4	92.2	149.4	53.6	0	0	0	0	106.9	E485	S483-E485 PolarHBondContact O-N 3.35Å
484	T	24.3	Very low	22.7	Very low	121 Å²	121	157.7 Å²	157.7	74%	0.742	79%	0.786	S	S	*	*			trans	-70.1	105.3	162.6	43.8	0	0	0	0	107.6
485	E	22.9	Very low	22.6	Very low	170 Å²	170	153 Å²	153	79%	0.794	78%	0.779	S	S	*	*			trans	-108.3	87.9	160.2	-78	-171.7	170.9	0	0	108.1	S483 F487	S483-E485 PolarHBondContact O-N 3.35Å; E485-F487 PolarHBondContact O-N 2.95Å
486	S	22.1	Very low	22.7	Very low	106 Å²	106	152.9 Å²	152.9	74%	0.741	78%	0.777	S	S	*	*			trans	-71.4	97.8	161.6	48.5	0	0	0	0	108.4
487	F	22.1	Very low	22.7	Very low	169 Å²	169	156.2 Å²	156.2	74%	0.741	78%	0.782	S	S	*	*			trans	-92.6	90	159.5	-104	-83.2	0	0	0	108.7	E485 K489	E485-F487 PolarHBondContact O-N 2.95Å; F487-K489 PolarHBondContact O-N 3.13Å; F487-K489 VanDerWaalsContact O-N 3.16Å
488	E	21.6	Very low	22.6	Very low	182 Å²	182	157.5 Å²	157.5	85%	0.85	78%	0.784	S	S	*	*			trans	-62.6	103.3	158	-72.6	177.9	154	0	0	108.3
489	K	24.1	Very low	22.8	Very low	180 Å²	180	157.6 Å²	157.6	78%	0.783	79%	0.785	S	S	*	*			trans	-107.8	87.1	162.2	-94.9	-176.4	177.4	176	0	109.2	F487	F487-K489 PolarHBondContact O-N 3.13Å; F487-K489 VanDerWaalsContact O-N 3.16Å
490	T	22.8	Very low	22.7	Very low	119 Å²	119	155.4 Å²	155.4	73%	0.73	78%	0.783	S	S	*	*			trans	16.8	104.6	139.2	37.9	0	0	0	0	116.5	K492	T490-K492 PolarHBondContact O-N 2.93Å
491	E	21.9	Very low	22.9	Very low	177 Å²	177	157.5 Å²	157.5	83%	0.827	79%	0.786	S	S	*	*			trans	-51.4	104.4	154.4	-65.7	-179.4	151.8	0	0	109.9
492	K	22.8	Very low	22.9	Very low	180 Å²	180	154.8 Å²	154.8	78%	0.783	78%	0.78	S	S	*	*			trans	-97.8	89.2	156.8	-87.9	-174.5	176.5	179.6	0	107.8	T490 Q494	T490-K492 PolarHBondContact O-N 2.93Å; K492-Q494 PolarHBondContact O-N 2.74Å
493	R	21	Very low	23.1	Very low	227 Å²	227	150.6 Å²	150.6	86%	0.857	78%	0.775	S	S	*	*			trans	-58.7	100	155.6	-75.2	179.6	174	-173	-2.7	107.6
494	Q	22.7	Very low	23	Very low	154 Å²	154	150.6 Å²	150.6	72%	0.72	78%	0.775	S	S	*	*			trans	-99.6	94.5	156.2	-78.7	-173.9	-18.2	0	0	106.9	K492 I496	K492-Q494 PolarHBondContact O-N 2.74Å; Q494-I496 PolarHBondContact O-N 3.1Å; Q494-I496 VanDerWaalsContact O-N 3.1Å
495	S	20.6	Very low	23	Very low	106 Å²	106	150.1 Å²	150.1	74%	0.741	77%	0.772	S	S	*	*			trans	-57.7	99.8	155.5	49.4	0	0	0	0	107.9	Q497	S495-Q497 PolarHBondContact O-N 3.22Å
496	I	23.4	Very low	22.9	Very low	150 Å²	150	147.2 Å²	147.2	77%	0.769	77%	0.769	S	S	*	*			trans	-86.9	105.6	164.5	-63.9	176.3	0	0	0	105.1	Q494	Q494-I496 PolarHBondContact O-N 3.1Å; Q494-I496 VanDerWaalsContact O-N 3.1Å
497	Q	22.9	Very low	22.9	Very low	166 Å²	166	149.6 Å²	149.6	78%	0.776	77%	0.772	S	S	*	*			trans	-54	132.4	172.1	-86	166.5	-59.4	0	0	110	S495 T499	S495-Q497 PolarHBondContact O-N 3.22Å; Q497-T499 PolarHBondContact O-N 3.41Å
498	E	21.9	Very low	22.9	Very low	183 Å²	183	147.2 Å²	147.2	86%	0.855	77%	0.771	S	S	*	*			trans	-55.5	98.5	161.8	-65.8	169.6	162.5	0	0	108.8	N500	E498-N500 PolarHBondContact O-N 3.18Å
499	T	25	Very low	22.8	Very low	117 Å²	117	149.8 Å²	149.8	72%	0.718	77%	0.773	S	S	*	*			trans	-84.3	98	165.7	50.3	0	0	0	0	107.8	Q497 D501	Q497-T499 PolarHBondContact O-N 3.41Å; T499-D501 VanDerWaalsContact C-N 3.29Å; T499-D501 PolarHBondContact O-N 3.31Å
500	N	24.2	Very low	22.8	Very low	152 Å²	152	147.6 Å²	147.6	81%	0.813	78%	0.777	S	S	*	*			trans	-65.6	89.3	160.5	-73.1	-35.3	0	0	0	108.6	E498	E498-N500 PolarHBondContact O-N 3.18Å
501	D	26.4	Very low	22.8	Very low	144 Å²	144	146.6 Å²	146.6	77%	0.77	78%	0.775	S	S	*	*			trans	-125.3	121.2	162.7	-83.6	-35.7	0	0	0	110.1	T499	T499-D501 VanDerWaalsContact C-N 3.29Å; T499-D501 PolarHBondContact O-N 3.31Å
502	S	23.5	Very low	22.8	Very low	99 Å²	99	148.6 Å²	148.6	69%	0.692	78%	0.775	S	S	*	*			trans	-44.9	134.1	173.9	51.8	0	0	0	0	114.2
503	N	25.2	Very low	22.8	Very low	151 Å²	151	146.8 Å²	146.8	81%	0.807	78%	0.784	S	S	*	*			trans	-152.7	91.4	140.8	-94.8	-30.5	0	0	0	109.6	V505	N503-V505 VanDerWaalsContact C-N 3.28Å; N503-V505 HydrophobicContact CB-CG2 4.44Å; N503-V505 PolarHBondContact O-N 2.67Å
504	S	22.6	Very low	22.8	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	78%	0.777	S	S	*	*			trans	-60	90.2	158.4	49.6	0	0	0	0	108.9	C506	S504-C506 PolarHBondContact O-N 2.97Å
505	V	22.3	Very low	22.8	Very low	111 Å²	111	140.5 Å²	140.5	67%	0.673	78%	0.781	S	S	*	*			trans	-88.6	92.6	165.6	-176.4	0	0	0	0	107.2	N503 I507	N503-V505 VanDerWaalsContact C-N 3.28Å; N503-V505 HydrophobicContact CB-CG2 4.44Å; N503-V505 PolarHBondContact O-N 2.67Å; V505-I507 HydrophobicContact CG1-CG1 3.91Å; V505-I507 PolarHBondContact O-N 3.46Å
506	C	20.8	Very low	23.2	Very low	108 Å²	108	141.2 Å²	141.2	73%	0.73	78%	0.783	S	S	*	*			trans	-58.9	97.8	162.2	-65.2	0	0	0	0	108.4	S504 T508	S504-C506 PolarHBondContact O-N 2.97Å; C506-T508 PolarHBondContact O-N 3.26Å; C506-T508 VanDerWaalsContact O-N 3.16Å
507	I	22.9	Very low	23.1	Very low	156 Å²	156	145.9 Å²	145.9	80%	0.8	79%	0.791	S	S	*	*			trans	-81.7	93.8	166.1	-57.8	-179.9	0	0	0	106.4	V505	V505-I507 HydrophobicContact CG1-CG1 3.91Å; V505-I507 PolarHBondContact O-N 3.46Å
508	T	21.6	Very low	23.2	Very low	120 Å²	120	146.6 Å²	146.6	74%	0.736	80%	0.799	S	S	*	*			trans	-58.9	131.4	169.4	38.4	0	0	0	0	110.2	C506	C506-T508 PolarHBondContact O-N 3.26Å; C506-T508 VanDerWaalsContact O-N 3.16Å
509	R	21.1	Very low	23.2	Very low	235 Å²	235	142.8 Å²	142.8	89%	0.887	79%	0.793	S	S	*	*			trans	-56.4	132.8	171.7	-75.4	175.7	170.2	159	-4.1	110.2	S511	R509-S511 PolarHBondContact O-N 3.14Å
510	P	23.5	Very low	23.1	Very low	134 Å²	134	146 Å²	146	87%	0.87	80%	0.8	S	S	*	*			trans	-77.1	108.7	170.5	25.9	-21.8	0	0	0	109.2
511	S	22.6	Very low	23	Very low	99 Å²	99	145.4 Å²	145.4	69%	0.692	80%	0.802	S	S	*	*			trans	-92.2	136.3	168.4	56.7	0	0	0	0	110.7	R509	R509-S511 PolarHBondContact O-N 3.14Å
512	R	21.4	Very low	22.6	Very low	219 Å²	219	147.1 Å²	147.1	83%	0.826	81%	0.807	S	S	*	*			trans	65	102.5	153.5	-65.9	-179.4	178.1	175.5	-2	117.8
513	C	22.4	Very low	22.6	Very low	141 Å²	141	150.2 Å²	150.2	95%	0.953	81%	0.814	S	S	*	*			trans	-113.1	95.4	141.2	-69.4	0	0	0	0	108.1
514	D	22.1	Very low	22.5	Very low	136 Å²	136	147.8 Å²	147.8	73%	0.727	81%	0.807	S	S	*	*			trans	-84.7	134	159.7	-79.7	-52.4	0	0	0	108.8
515	S	22.4	Very low	22.3	Very low	114 Å²	114	149.8 Å²	149.8	80%	0.797	81%	0.808	S	S	*	*			trans	168.1	154.7	144.9	50.5	0	0	0	0	110.5
516	P	29.8	Very low	22.3	Very low	121 Å²	121	148.7 Å²	148.7	79%	0.786	81%	0.806	S	S	*	*				-130.7	167.6	-77.9	25.2	-2.9	0	0	0	113.9	L518	P516-L518 PolarHBondContact O-N 2.86Å
517	R	20.6	Very low	22.4	Very low	248 Å²	248	152.7 Å²	152.7	94%	0.936	81%	0.81	S	S	*	*			trans	-37.7	120.7	170	-68.8	171.4	170.5	172.9	-4.5	114.1
518	L	25.3	Very low	22.5	Very low	180 Å²	180	153.7 Å²	153.7	94%	0.942	81%	0.812	S	S	*	*			trans	-85.4	121.2	156.7	-87	160.8	0	0	0	109.2	P516	P516-L518 PolarHBondContact O-N 2.86Å
519	S	22.1	Very low	22.6	Very low	104 Å²	104	153.4 Å²	153.4	73%	0.727	81%	0.812	S	S	*	*			trans	-74.4	145.4	-178.1	49.2	0	0	0	0	113.5
520	Q	22	Very low	22.6	Very low	185 Å²	185	148 Å²	148	86%	0.864	81%	0.811	S	S	*	*			trans	-23	134.4	161.9	-64.3	162.8	-20.2	0	0	116.7
521	T	22.5	Very low	22.4	Very low	139 Å²	139	147.2 Å²	147.2	85%	0.853	81%	0.806	S	S	*	*			trans	-137.1	122.8	146.2	37.9	0	0	0	0	109.2
522	M	18.3	Very low	22.4	Very low	179 Å²	179	148.7 Å²	148.7	88%	0.882	81%	0.812	S	S	*	*			trans	-84.4	135.4	174.6	-66.7	-163.4	124	0	0	110.4
523	I	23.1	Very low	22.4	Very low	164 Å²	164	143.4 Å²	143.4	84%	0.841	81%	0.808	S	S	*	*			trans	-137.7	112.8	157.2	-57.5	179.1	0	0	0	107.8
524	P	22.6	Very low	22.4	Very low	100 Å²	100	140.9 Å²	140.9	65%	0.649	79%	0.792	S	S	*	*			trans	-102.5	171.7	177.3	38.1	-31.3	0	0	0	112.7
525	L	19.8	Very low	22.5	Very low	152 Å²	152	145.4 Å²	145.4	80%	0.796	80%	0.801	S	S	*	*			trans	95.8	105.3	155.8	-65.8	156.6	0	0	0	120.2
526	S	21.5	Very low	22.6	Very low	89 Å²	89	145.4 Å²	145.4	62%	0.622	80%	0.801	S	S	*	*				91.9	143.2	112.8	80.6	0	0	0	0	120.8
527	K	23.7	Very low	22.4	Very low	191 Å²	191	148.5 Å²	148.5	83%	0.83	81%	0.805	S	S	*	*			trans	80.6	134.3	158.3	-62.1	175.1	-177.6	-179.5	0	115.8
528	Q	23.3	Very low	22.7	Very low	178 Å²	178	140 Å²	140	83%	0.832	80%	0.795	S	S	*	*			cis	-157.3	166.4	14.8	-86.5	-138.5	-37.2	0	0	110.9
529	P	23.9	Very low	22.8	Very low	113 Å²	113	142 Å²	142	73%	0.734	79%	0.791	S	S	*	*			trans	-95.2	156.1	176.9	37.2	-30.4	0	0	0	113.3
530	S	22.7	Very low	23.1	Very low	123 Å²	123	143.1 Å²	143.1	86%	0.86	79%	0.794	S	S	*	*			trans	-135.4	134.7	164.1	55.4	0	0	0	0	110.8
531	C	18.9	Very low	23.9	Very low	116 Å²	116	140.8 Å²	140.8	78%	0.784	79%	0.792	S	S	*	*			trans	-81.9	159.9	-179.3	-57.9	0	0	0	0	111.1
532	T	22.3	Very low	24.8	Very low	131 Å²	131	135.7 Å²	135.7	80%	0.804	76%	0.762	S	S	*	*				167.4	129.9	120.7	36.2	0	0	0	0	113.7
533	S	21.1	Very low	26	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	75%	0.752	S	S	*	*			trans	51.9	139.1	142.1	68.2	0	0	0	0	121.4
534	S	22.9	Very low	26.9	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	72%	0.722	S	S	*	*			cis	174.4	145.6	-0.2	48.4	0	0	0	0	108.9
535	Y	24	Very low	28.3	Very low	230 Å²	230	128 Å²	128	90%	0.902	71%	0.714	S	S	*	*			trans	73.7	131.2	168.9	-61	-83.8	0	0	0	116.8
536	S	25.2	Very low	29.9	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	71%	0.714	S	S	*	*			cis	-156.7	136.2	17.9	50	0	0	0	0	111.7
537	E	24.2	Very low	31.3	Very low	187 Å²	187	131.5 Å²	131.5	87%	0.874	71%	0.708	S	S	*	*			trans	-85.9	142.1	169.9	-65.6	173.7	149.5	0	0	111.3
538	G	28	Very low	32.7	Very low	70 Å²	70	123.1 Å²	123.1	72%	0.722	67%	0.673	S	S	*	*			trans	173.1	99.6	175.2	0	0	0	0	0	112.7
539	Y	27.5	Very low	34.2	Very low	220 Å²	220	119.5 Å²	119.5	86%	0.863	66%	0.66	S	S	*	*			trans	-73.2	113.7	-167.8	-69.2	-105.8	0	0	0	114.3
540	T	28.6	Very low	35.5	Very low	128 Å²	128	119.7 Å²	119.7	79%	0.785	65%	0.651	S	S	*	*			trans	-126	118.3	149.2	49.1	0	0	0	0	107.5	S542	T540-S542 PolarHBondContact O-N 3.47Å
541	V	37.3	Very low	36.8	Very low	137 Å²	137	115.9 Å²	115.9	83%	0.83	62%	0.62	S	S	*	*			trans	-50.8	102	177.9	179.8	0	0	0	0	108.3
542	S	42	Very low	38.7	Very low	32 Å²	32	113.4 Å²	113.4	22%	0.224	61%	0.605	C	S	.	*			trans	-66.8	144.1	-167.9	55.9	0	0	0	0	110.2	T540 E544 R545	T540-S542 PolarHBondContact O-N 3.47Å; S542-E544 VanDerWaalsContact CB-CD 3.45Å; S542-E544 WeakPolarHBondContact CB-OE2 3.37Å; S542-E544 PolarHBondContact O-N 2.94Å; S542-E544 WeakPolarHBondContact OG-CB 3.48Å; S542-E544 PolarHBondContact OG-OE2 3.18Å; S542-R545 PolarHBondContact O-N 3.03Å
543	T	42.4	Very low	39.8	Very low	111 Å²	111	114.7 Å²	114.7	68%	0.681	60%	0.601	S	S	*	*	H	α-helix	trans	-47	-22.4	167.2	35.3	0	0	0	0	113	R546 M547	T543-R546 PolarHBondContact O-N 2.91Å; T543-M547 PolarHBondContact O-N 3.39Å
544	E	43.6	Very low	41	Very low	42 Å²	42	116.4 Å²	116.4	20%	0.196	59%	0.591	C	S	.	*	H	α-helix	trans	-59.8	-43.9	176.2	-59.5	144.1	-164.3	0	0	112.2	S542 R546 M547 V548 F574	S542-E544 VanDerWaalsContact CB-CD 3.45Å; S542-E544 WeakPolarHBondContact CB-OE2 3.37Å; S542-E544 PolarHBondContact O-N 2.94Å; S542-E544 WeakPolarHBondContact OG-CB 3.48Å; S542-E544 PolarHBondContact OG-OE2 3.18Å; E544-R546 VanDerWaalsContact C-N 3.28Å; E544-R546 PolarHBondContact O-N 3.34Å; E544-M547 WeakPolarHBondContact O-CB 3.25Å; E544-M547 PolarHBondContact O-N 2.96Å; E544-V548 WeakPolarHBondContact O-CG2 3.35Å; E544-V548 PolarHBondContact O-N 3.45Å; E544-F574 HydrophobicContact CG-CD2 3.99Å; E544-F574 HydrophobicContact CG-CE2 4.22Å
545	R	52.1	Low	42.2	Very low	129 Å²	129	122.6 Å²	122.6	49%	0.487	60%	0.603	S	S	.	*	H	α-helix	trans	-63.6	-34.6	-176.8	-152.7	166.4	-171.3	152.7	1.8	112.3	S542 V548 D549 S567	S542-R545 PolarHBondContact O-N 3.03Å; R545-V548 PolarHBondContact O-N 3.4Å; R545-D549 PolarHBondContact O-N 3.07Å; R545-S567 PolarHBondContact NH1-O 3.03Å
546	R	53.7	Low	43.6	Very low	212 Å²	212	114.7 Å²	114.7	80%	0.8	58%	0.575	S	S	*	*	H	α-helix	trans	-67.3	-39.5	172.3	-95.4	-176	-179.1	157.1	0.9	112.8	T543 E544 V548 E550	T543-R546 PolarHBondContact O-N 2.91Å; E544-R546 VanDerWaalsContact C-N 3.28Å; E544-R546 PolarHBondContact O-N 3.34Å; R546-V548 VanDerWaalsContact C-N 3.31Å; R546-E550 PolarHBondContact O-N 2.98Å
547	M	50.8	Low	44.9	Very low	101 Å²	101	110.8 Å²	110.8	50%	0.498	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-35.9	176.9	-73.2	177.1	165.9	0	0	111.6	T543 E544 E550 L551	T543-M547 PolarHBondContact O-N 3.39Å; E544-M547 WeakPolarHBondContact O-CB 3.25Å; E544-M547 PolarHBondContact O-N 2.96Å; M547-E550 PolarHBondContact O-N 2.92Å; M547-L551 WeakPolarHBondContact O-CB 3.31Å; M547-L551 VanDerWaalsContact O-CG 3.3Å; M547-L551 WeakPolarHBondContact O-CG 3.24Å; M547-L551 PolarHBondContact O-N 3.37Å
548	V	52.6	Low	46.2	Very low	16 Å²	16	107.7 Å²	107.7	10%	0.097	53%	0.534	C	S	.	.	H	α-helix	trans	-63.4	-47.9	177.4	-173	0	0	0	0	111.7	E544 R545 R546 E550 L551 S552 L557 L563 L566	E544-V548 WeakPolarHBondContact O-CG2 3.35Å; E544-V548 PolarHBondContact O-N 3.45Å; R545-V548 PolarHBondContact O-N 3.4Å; R546-V548 VanDerWaalsContact C-N 3.31Å; V548-E550 VanDerWaalsContact C-N 3.25Å; V548-E550 PolarHBondContact O-N 3.13Å; V548-L551 PolarHBondContact O-N 2.79Å; V548-S552 VanDerWaalsContact O-CB 3.31Å; V548-S552 WeakPolarHBondContact O-CB 3.44Å; V548-S552 PolarHBondContact O-N 3.18Å; V548-L557 HydrophobicContact CG1-CD1 3.87Å; V548-L563 HydrophobicContact CG1-CD2 3.67Å; V548-L566 HydrophobicContact CG2-CB 3.99Å; V548-L566 HydrophobicContact CG2-CD2 3.25Å; V548-L566 HydrophobicContact CG2-CG 4.15Å
549	D	54.7	Low	47.4	Very low	102 Å²	102	112.6 Å²	112.6	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-60.7	-37.7	179.6	-70.3	-19.7	0	0	0	111.3	R545 Q553	R545-D549 PolarHBondContact O-N 3.07Å; D549-Q553 WeakPolarHBondContact O-CG 3.45Å; D549-Q553 PolarHBondContact O-N 3.14Å
550	E	50.9	Low	48.7	Very low	116 Å²	116	111.2 Å²	111.2	54%	0.542	54%	0.542	S	S	.	.	H	α-helix	trans	-73.4	-37.7	-179.6	-146.4	-179.8	-175.3	0	0	112.8	R546 M547 V548	R546-E550 PolarHBondContact O-N 2.98Å; M547-E550 PolarHBondContact O-N 2.92Å; V548-E550 VanDerWaalsContact C-N 3.25Å; V548-E550 PolarHBondContact O-N 3.13Å
551	L	51.2	Low	50	Low	43 Å²	43	106.2 Å²	106.2	23%	0.225	51%	0.511	C	S	.	.	H	α-helix	trans	-74.1	-32.8	175.8	-70.6	169.3	0	0	0	112.5	M547 V548 R554 M556 L557 V577	M547-L551 WeakPolarHBondContact O-CB 3.31Å; M547-L551 VanDerWaalsContact O-CG 3.3Å; M547-L551 WeakPolarHBondContact O-CG 3.24Å; M547-L551 PolarHBondContact O-N 3.37Å; V548-L551 PolarHBondContact O-N 2.79Å; L551-R554 PolarHBondContact O-N 3.38Å; L551-M556 HydrophobicContact CD2-CB 4.19Å; L551-M556 HydrophobicContact CD2-SD 4.23Å; L551-M556 PolarHBondContact O-N 3.27Å; L551-M556 VanDerWaalsContact O-N 3.11Å; L551-L557 HydrophobicContact CB-CD1 4.1Å; L551-L557 HydrophobicContact CB-CD2 4.08Å; L551-L557 HydrophobicContact CB-CG 3.8Å; L551-L557 HydrophobicContact CD1-CD2 4.44Å; L551-V577 HydrophobicContact CD1-CG1 3.69Å
552	S	57.6	Low	51.1	Low	65 Å²	65	103.8 Å²	103.8	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-45.4	173.9	-173.9	0	0	0	0	111.3	V548 R554 Y555	V548-S552 VanDerWaalsContact O-CB 3.31Å; V548-S552 WeakPolarHBondContact O-CB 3.44Å; V548-S552 PolarHBondContact O-N 3.18Å; S552-R554 PolarHBondContact O-N 2.86Å; S552-Y555 PolarHBondContact O-N 2.86Å; S552-Y555 VanDerWaalsContact O-N 3.11Å
553	Q	46.6	Very low	51.8	Low	158 Å²	158	106.7 Å²	106.7	74%	0.738	51%	0.506	S	S	*	.	H	α-helix	trans	-63.6	-26.1	178	-74.9	178.7	13.6	0	0	113.9	D549 Y555	D549-Q553 WeakPolarHBondContact O-CG 3.45Å; D549-Q553 PolarHBondContact O-N 3.14Å; Q553-Y555 VanDerWaalsContact C-N 3.31Å
554	R	44.8	Very low	52.5	Low	142 Å²	142	107.3 Å²	107.3	54%	0.536	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	7.1	178	-65.5	-170.7	-175.7	-171.9	4.8	113.6	L551 S552 M556 L584	L551-R554 PolarHBondContact O-N 3.38Å; S552-R554 PolarHBondContact O-N 2.86Å; R554-M556 HydrophobicContact CB-CB 4.42Å; R554-M556 HydrophobicContact CB-CG 3.83Å; R554-M556 HydrophobicContact CB-SD 4.38Å; R554-M556 PolarHBondContact O-N 3.29Å; R554-M556 VanDerWaalsContact O-N 3.12Å; R554-L584 VanDerWaalsContact NH1-CD1 3.3Å
555	Y	48.3	Very low	53.3	Low	219 Å²	219	109.1 Å²	109.1	86%	0.859	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	29.8	-171.6	-61.7	-86.4	0	0	0	112.7	S552 Q553	S552-Y555 PolarHBondContact O-N 2.86Å; S552-Y555 VanDerWaalsContact O-N 3.11Å; Q553-Y555 VanDerWaalsContact C-N 3.31Å
556	M	53.1	Low	53.3	Low	65 Å²	65	103.3 Å²	103.3	32%	0.32	49%	0.492	S	S	.	.			trans	-93.5	-6.5	-179.5	-72.9	-162.9	83	0	0	113.4	L551 R554 L584	L551-M556 HydrophobicContact CD2-CB 4.19Å; L551-M556 HydrophobicContact CD2-SD 4.23Å; L551-M556 PolarHBondContact O-N 3.27Å; L551-M556 VanDerWaalsContact O-N 3.11Å; R554-M556 HydrophobicContact CB-CB 4.42Å; R554-M556 HydrophobicContact CB-CG 3.83Å; R554-M556 HydrophobicContact CB-SD 4.38Å; R554-M556 PolarHBondContact O-N 3.29Å; R554-M556 VanDerWaalsContact O-N 3.12Å; M556-L584 HydrophobicContact CE-CD1 4.06Å; M556-L584 HydrophobicContact CE-CD2 4.48Å; M556-L584 HydrophobicContact CE-CG 3.74Å; M556-L584 HydrophobicContact SD-CD1 3.12Å; M556-L584 WeakPolarHBondContact SD-CD1 3.48Å; M556-L584 HydrophobicContact SD-CD2 4.44Å; M556-L584 HydrophobicContact SD-CG 3.53Å; M556-L584 VanDerWaalsContact SD-CG 3.53Å
557	L	53.6	Low	53.4	Low	32 Å²	32	95.2 Å²	95.2	17%	0.168	47%	0.468	C	S	.	.	S	Bend	trans	-90.7	113.7	172.3	-68.9	172.4	0	0	0	109	V548 L551 L563 V577	V548-L557 HydrophobicContact CG1-CD1 3.87Å; L551-L557 HydrophobicContact CB-CD1 4.1Å; L551-L557 HydrophobicContact CB-CD2 4.08Å; L551-L557 HydrophobicContact CB-CG 3.8Å; L551-L557 HydrophobicContact CD1-CD2 4.44Å; L557-L563 HydrophobicContact CD1-CD2 4.24Å; L557-V577 HydrophobicContact CD2-CG1 4.37Å; L557-V577 HydrophobicContact CD2-CG2 3.95Å
558	L	50.6	Low	53.9	Low	122 Å²	122	94.8 Å²	94.8	64%	0.639	48%	0.475	S	S	*	.			trans	-68.5	145.9	171.6	-81.6	115.8	0	0	0	110.9	K560 V561	L558-K560 PolarHBondContact O-N 3.16Å; L558-V561 PolarHBondContact O-N 3.24Å; L558-V561 VanDerWaalsContact O-N 3.14Å
559	D	53.1	Low	53.8	Low	173 Å²	173	95.7 Å²	95.7	93%	0.925	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-3.4	-177.6	-64.7	-28.3	0	0	0	116.9
560	K	56.1	Low	53.9	Low	190 Å²	190	91.6 Å²	91.6	83%	0.826	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	4.3	-177.9	-67.5	-171.9	178	-178.6	0	114.6	L558	L558-K560 PolarHBondContact O-N 3.16Å
561	V	56.1	Low	54	Low	23 Å²	23	92.2 Å²	92.2	14%	0.139	47%	0.472	C	S	.	.	S	Bend	trans	-86	117.7	175.8	-178.9	0	0	0	0	109.1	L558 L563 L566 V577	L558-V561 PolarHBondContact O-N 3.24Å; L558-V561 VanDerWaalsContact O-N 3.14Å; V561-L563 PolarHBondContact O-N 3.29Å; V561-L566 HydrophobicContact CG1-CD1 3.14Å; V561-V577 HydrophobicContact CG1-CG2 3.7Å; V561-V577 HydrophobicContact CG2-CG2 4.21Å
562	N	59.1	Low	54.4	Low	87 Å²	87	94.1 Å²	94.1	47%	0.465	49%	0.485	S	S	.	.			trans	-71.7	98.1	177.2	-168.1	-2.6	0	0	0	110	D564 E565 L566	N562-D564 PolarHBondContact O-N 3.3Å; N562-D564 PolarHBondContact OD1-N 3.22Å; N562-E565 HydrophobicContact CB-CB 4.06Å; N562-E565 PolarHBondContact O-N 2.93Å; N562-E565 VanDerWaalsContact O-N 3.14Å; N562-L566 PolarHBondContact O-N 2.93Å
563	L	56.6	Low	54.4	Low	93 Å²	93	91.2 Å²	91.2	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-32.8	-176.5	-66.7	167.8	0	0	0	112.3	V548 L557 V561 E565 L566 S567	V548-L563 HydrophobicContact CG1-CD2 3.67Å; L557-L563 HydrophobicContact CD1-CD2 4.24Å; V561-L563 PolarHBondContact O-N 3.29Å; L563-E565 VanDerWaalsContact C-N 3.3Å; L563-E565 PolarHBondContact O-N 2.95Å; L563-L566 PolarHBondContact O-N 2.99Å; L563-S567 WeakPolarHBondContact O-CB 3.41Å; L563-S567 PolarHBondContact O-N 3.33Å
564	D	58.2	Low	54.9	Low	124 Å²	124	86.6 Å²	86.6	66%	0.663	44%	0.443	S	S	*	.	H	α-helix	trans	-66.1	-35.4	178.3	-69.8	-27.3	0	0	0	111.7	N562 S567 S568	N562-D564 PolarHBondContact O-N 3.3Å; N562-D564 PolarHBondContact OD1-N 3.22Å; D564-S567 PolarHBondContact O-N 3.14Å; D564-S567 PolarHBondContact O-OG 3.33Å; D564-S567 VanDerWaalsContact O-OG 3.06Å; D564-S568 PolarHBondContact O-N 2.99Å; D564-S568 PolarHBondContact O-OG 3.38Å
565	E	58.9	Low	55.4	Low	80 Å²	80	86 Å²	86	37%	0.374	45%	0.446	S	S	.	.	H	α-helix	trans	-74.8	-36.4	178.9	-141.8	-178.6	-144.7	0	0	111.6	N562 L563 S567 S568 G569 G570 T572 A573	N562-E565 HydrophobicContact CB-CB 4.06Å; N562-E565 PolarHBondContact O-N 2.93Å; N562-E565 VanDerWaalsContact O-N 3.14Å; L563-E565 VanDerWaalsContact C-N 3.3Å; L563-E565 PolarHBondContact O-N 2.95Å; E565-S567 VanDerWaalsContact C-N 3.35Å; E565-S568 WeakPolarHBondContact CA-OG 3.44Å; E565-S568 PolarHBondContact O-N 3.37Å; E565-S568 PolarHBondContact O-OG 3.15Å; E565-G569 PolarHBondContact O-N 3.3Å; E565-G570 WeakPolarHBondContact O-CA 3.27Å; E565-G570 PolarHBondContact O-N 3.18Å; E565-T572 PolarHBondContact OE2-OG1 3.35Å; E565-A573 HydrophobicContact CB-CB 4.02Å
566	L	53.6	Low	55.9	Low	7 Å²	7	78.7 Å²	78.7	4%	0.037	42%	0.423	C	S	.	.	H	α-helix	trans	-65.3	-38.2	168	-98.6	119.4	0	0	0	112.2	V548 V561 N562 L563 S568 G569 A573 V577	V548-L566 HydrophobicContact CG2-CB 3.99Å; V548-L566 HydrophobicContact CG2-CD2 3.25Å; V548-L566 HydrophobicContact CG2-CG 4.15Å; V561-L566 HydrophobicContact CG1-CD1 3.14Å; N562-L566 PolarHBondContact O-N 2.93Å; L563-L566 PolarHBondContact O-N 2.99Å; L566-S568 PolarHBondContact O-N 2.94Å; L566-G569 PolarHBondContact O-N 3.08Å; L566-A573 HydrophobicContact CB-CB 4.43Å; L566-A573 HydrophobicContact CD1-CB 3.54Å; L566-A573 HydrophobicContact CG-CB 3.77Å; L566-V577 HydrophobicContact CD1-CG2 3.68Å; L566-V577 HydrophobicContact CD2-CG2 4.12Å
567	S	54.6	Low	56	Low	42 Å²	42	76.3 Å²	76.3	29%	0.294	41%	0.411	S	S	.	.	H	α-helix	trans	-68	-22.8	-179.4	100	0	0	0	0	113.4	R545 L563 D564 E565	R545-S567 PolarHBondContact NH1-O 3.03Å; L563-S567 WeakPolarHBondContact O-CB 3.41Å; L563-S567 PolarHBondContact O-N 3.33Å; D564-S567 PolarHBondContact O-N 3.14Å; D564-S567 PolarHBondContact O-OG 3.33Å; D564-S567 VanDerWaalsContact O-OG 3.06Å; E565-S567 VanDerWaalsContact C-N 3.35Å
568	S	62.5	Low	55.8	Low	92 Å²	92	80 Å²	80	64%	0.643	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	8.5	179.4	50.9	0	0	0	0	113.6	D564 E565 L566	D564-S568 PolarHBondContact O-N 2.99Å; D564-S568 PolarHBondContact O-OG 3.38Å; E565-S568 WeakPolarHBondContact CA-OG 3.44Å; E565-S568 PolarHBondContact O-N 3.37Å; E565-S568 PolarHBondContact O-OG 3.15Å; L566-S568 PolarHBondContact O-N 2.94Å
569	G	50	Low	56	Low	34 Å²	34	78.1 Å²	78.1	35%	0.351	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	26.7	176.7	0	0	0	0	0	113.7	E565 L566 Q571	E565-G569 PolarHBondContact O-N 3.3Å; L566-G569 PolarHBondContact O-N 3.08Å; G569-Q571 PolarHBondContact O-N 3.11Å
570	G	56.5	Low	56.1	Low	16 Å²	16	75.1 Å²	75.1	17%	0.165	41%	0.405	C	S	.	.			trans	-66.8	113.2	177.5	0	0	0	0	0	112.2	E565 T572 A573 F574	E565-G570 WeakPolarHBondContact O-CA 3.27Å; E565-G570 PolarHBondContact O-N 3.18Å; G570-T572 PolarHBondContact O-N 2.98Å; G570-T572 VanDerWaalsContact O-N 3.16Å; G570-A573 PolarHBondContact O-N 2.87Å; G570-F574 PolarHBondContact O-N 2.93Å; G570-F574 VanDerWaalsContact O-N 3.17Å
571	Q	52.5	Low	55.6	Low	129 Å²	129	67.9 Å²	67.9	60%	0.603	38%	0.378	S	S	*	.	H	α-helix	trans	-57.3	-30.2	178.6	-149.3	74.7	-10.8	0	0	113.1	G569 Q575	G569-Q571 PolarHBondContact O-N 3.11Å; Q571-Q575 WeakPolarHBondContact O-CB 3.38Å; Q571-Q575 WeakPolarHBondContact O-CG 3.45Å; Q571-Q575 PolarHBondContact O-N 2.87Å
572	T	59.9	Low	54.8	Low	83 Å²	83	72.7 Å²	72.7	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-66.6	-47.7	178.1	42.4	0	0	0	0	111.8	E565 G570 Q575 D576	E565-T572 PolarHBondContact OE2-OG1 3.35Å; G570-T572 PolarHBondContact O-N 2.98Å; G570-T572 VanDerWaalsContact O-N 3.16Å; T572-Q575 PolarHBondContact O-N 3.18Å; T572-D576 WeakPolarHBondContact O-CB 3.19Å; T572-D576 PolarHBondContact O-N 2.93Å
573	A	58	Low	53.7	Low	5 Å²	5	76 Å²	76	4%	0.041	43%	0.425	C	S	.	.	H	α-helix	trans	-70	-37.1	-179.7	0	0	0	0	0	111.4	E565 L566 G570 D576 V577	E565-A573 HydrophobicContact CB-CB 4.02Å; L566-A573 HydrophobicContact CB-CB 4.43Å; L566-A573 HydrophobicContact CD1-CB 3.54Å; L566-A573 HydrophobicContact CG-CB 3.77Å; G570-A573 PolarHBondContact O-N 2.87Å; A573-D576 PolarHBondContact O-N 3.37Å; A573-V577 WeakPolarHBondContact O-CG2 3.19Å; A573-V577 PolarHBondContact O-N 2.89Å
574	F	56.1	Low	52.4	Low	60 Å²	60	76.2 Å²	76.2	26%	0.263	43%	0.426	S	S	.	.	H	α-helix	trans	-63.9	-43.8	171	-176.8	-98.8	0	0	0	112.2	E544 G570 D576 V577 M578	E544-F574 HydrophobicContact CG-CD2 3.99Å; E544-F574 HydrophobicContact CG-CE2 4.22Å; G570-F574 PolarHBondContact O-N 2.93Å; G570-F574 VanDerWaalsContact O-N 3.17Å; F574-D576 VanDerWaalsContact C-N 3.29Å; F574-D576 PolarHBondContact O-N 3.36Å; F574-V577 PolarHBondContact O-N 3.31Å; F574-M578 HydrophobicContact CD1-CG 3.91Å; F574-M578 HydrophobicContact CD2-CG 4.46Å; F574-M578 HydrophobicContact CE1-CG 3.5Å; F574-M578 VanDerWaalsContact CE1-CG 3.5Å; F574-M578 HydrophobicContact CE1-SD 4.3Å; F574-M578 HydrophobicContact CE2-CG 4.09Å; F574-M578 HydrophobicContact CE2-SD 4.36Å; F574-M578 HydrophobicContact CG-CG 4.38Å; F574-M578 HydrophobicContact CZ-CG 3.59Å; F574-M578 HydrophobicContact CZ-SD 3.86Å; F574-M578 WeakPolarHBondContact O-CB 3.49Å; F574-M578 VanDerWaalsContact O-CG 3.29Å; F574-M578 WeakPolarHBondContact O-CG 3.38Å; F574-M578 PolarHBondContact O-N 3.28Å
575	Q	56.3	Low	50.9	Low	129 Å²	129	73.3 Å²	73.3	60%	0.603	43%	0.426	S	S	*	.	H	α-helix	trans	-62.6	-36.2	172.2	-85.6	-169.7	-12.4	0	0	112.2	Q571 T572 M578 S579	Q571-Q575 WeakPolarHBondContact O-CB 3.38Å; Q571-Q575 WeakPolarHBondContact O-CG 3.45Å; Q571-Q575 PolarHBondContact O-N 2.87Å; T572-Q575 PolarHBondContact O-N 3.18Å; Q575-M578 PolarHBondContact O-N 3.02Å; Q575-S579 WeakPolarHBondContact O-CA 3.35Å; Q575-S579 WeakPolarHBondContact O-CB 3.41Å; Q575-S579 PolarHBondContact O-N 3.03Å; Q575-S579 PolarHBondContact O-OG 3.11Å
576	D	58.1	Low	49.5	Very low	67 Å²	67	74.5 Å²	74.5	36%	0.358	44%	0.442	S	S	.	.	H	α-helix	trans	-68.3	-37.3	177.4	-109.9	35.5	0	0	0	111.9	T572 A573 F574 S579 K580	T572-D576 WeakPolarHBondContact O-CB 3.19Å; T572-D576 PolarHBondContact O-N 2.93Å; A573-D576 PolarHBondContact O-N 3.37Å; F574-D576 VanDerWaalsContact C-N 3.29Å; F574-D576 PolarHBondContact O-N 3.36Å; D576-S579 WeakPolarHBondContact CA-OG 3.45Å; D576-S579 PolarHBondContact O-OG 3.32Å; D576-K580 WeakPolarHBondContact O-CB 3.47Å; D576-K580 WeakPolarHBondContact O-CD 3.44Å; D576-K580 VanDerWaalsContact O-CG 3.23Å; D576-K580 WeakPolarHBondContact O-CG 3.35Å; D576-K580 PolarHBondContact O-N 2.91Å; D576-K580 IonicContact OD1-NZ 3.12Å; D576-K580 IonicContact OD2-NZ 3.63Å; D576-K580 PolarHBondContact OD2-NZ 3.23Å
577	V	54.8	Low	48.1	Very low	14 Å²	14	79.8 Å²	79.8	9%	0.085	48%	0.475	C	S	.	.	H	α-helix	trans	-67.5	-54.6	171.2	173.1	0	0	0	0	109.7	L551 L557 V561 L566 A573 F574 S579 K580 S581	L551-V577 HydrophobicContact CD1-CG1 3.69Å; L557-V577 HydrophobicContact CD2-CG1 4.37Å; L557-V577 HydrophobicContact CD2-CG2 3.95Å; V561-V577 HydrophobicContact CG1-CG2 3.7Å; V561-V577 HydrophobicContact CG2-CG2 4.21Å; L566-V577 HydrophobicContact CD1-CG2 3.68Å; L566-V577 HydrophobicContact CD2-CG2 4.12Å; A573-V577 WeakPolarHBondContact O-CG2 3.19Å; A573-V577 PolarHBondContact O-N 2.89Å; F574-V577 PolarHBondContact O-N 3.31Å; V577-S579 VanDerWaalsContact C-N 3.3Å; V577-S579 PolarHBondContact O-N 3.03Å; V577-K580 CarbonylContact O-C 3.56Å; V577-K580 PolarHBondContact O-N 3.06Å; V577-K580 VanDerWaalsContact O-N 3.1Å; V577-S581 WeakPolarHBondContact O-CA 3.28Å; V577-S581 WeakPolarHBondContact O-CB 3.38Å; V577-S581 PolarHBondContact O-N 3.03Å; V577-S581 PolarHBondContact O-OG 3.25Å
578	M	50.8	Low	46.6	Very low	109 Å²	109	85.4 Å²	85.4	54%	0.537	50%	0.497	S	S	.	.	H	α-helix	trans	-60.7	-35.7	-178.8	-71.6	-66.5	-69.5	0	0	113.4	F574 Q575 S581	F574-M578 HydrophobicContact CD1-CG 3.91Å; F574-M578 HydrophobicContact CD2-CG 4.46Å; F574-M578 HydrophobicContact CE1-CG 3.5Å; F574-M578 VanDerWaalsContact CE1-CG 3.5Å; F574-M578 HydrophobicContact CE1-SD 4.3Å; F574-M578 HydrophobicContact CE2-CG 4.09Å; F574-M578 HydrophobicContact CE2-SD 4.36Å; F574-M578 HydrophobicContact CG-CG 4.38Å; F574-M578 HydrophobicContact CZ-CG 3.59Å; F574-M578 HydrophobicContact CZ-SD 3.86Å; F574-M578 WeakPolarHBondContact O-CB 3.49Å; F574-M578 VanDerWaalsContact O-CG 3.29Å; F574-M578 WeakPolarHBondContact O-CG 3.38Å; F574-M578 PolarHBondContact O-N 3.28Å; Q575-M578 PolarHBondContact O-N 3.02Å; M578-S581 WeakPolarHBondContact CA-OG 3.5Å
579	S	55.3	Low	44.7	Very low	83 Å²	83	87.5 Å²	87.5	58%	0.58	51%	0.505	S	S	*	.	H	α-helix	trans	-78	-21.5	178.8	63.8	0	0	0	0	113	Q575 D576 V577	Q575-S579 WeakPolarHBondContact O-CA 3.35Å; Q575-S579 WeakPolarHBondContact O-CB 3.41Å; Q575-S579 PolarHBondContact O-N 3.03Å; Q575-S579 PolarHBondContact O-OG 3.11Å; D576-S579 WeakPolarHBondContact CA-OG 3.45Å; D576-S579 PolarHBondContact O-OG 3.32Å; V577-S579 VanDerWaalsContact C-N 3.3Å; V577-S579 PolarHBondContact O-N 3.03Å
580	K	54.5	Low	43.4	Very low	111 Å²	111	93.5 Å²	93.5	48%	0.483	53%	0.528	S	S	.	.	H	α-helix	trans	-106	-14.9	178.8	-63.7	171.1	-176.1	159.1	0	113	D576 V577 V582	D576-K580 WeakPolarHBondContact O-CB 3.47Å; D576-K580 WeakPolarHBondContact O-CD 3.44Å; D576-K580 VanDerWaalsContact O-CG 3.23Å; D576-K580 WeakPolarHBondContact O-CG 3.35Å; D576-K580 PolarHBondContact O-N 2.91Å; D576-K580 IonicContact OD1-NZ 3.12Å; D576-K580 IonicContact OD2-NZ 3.63Å; D576-K580 PolarHBondContact OD2-NZ 3.23Å; V577-K580 CarbonylContact O-C 3.56Å; V577-K580 PolarHBondContact O-N 3.06Å; V577-K580 VanDerWaalsContact O-N 3.1Å; K580-V582 PolarHBondContact O-N 2.88Å
581	S	45.3	Very low	41.8	Very low	37 Å²	37	100.9 Å²	100.9	26%	0.259	56%	0.555	S	S	.	*			trans	-86.9	99.6	174.2	66.4	0	0	0	0	108.9	V577 M578	V577-S581 WeakPolarHBondContact O-CA 3.28Å; V577-S581 WeakPolarHBondContact O-CB 3.38Å; V577-S581 PolarHBondContact O-N 3.03Å; V577-S581 PolarHBondContact O-OG 3.25Å; M578-S581 WeakPolarHBondContact CA-OG 3.5Å
582	V	40.1	Very low	40.5	Very low	125 Å²	125	102.9 Å²	102.9	76%	0.758	57%	0.565	S	S	*	*			trans	-90.3	129.2	169.1	179.6	0	0	0	0	108.4	K580 L584	K580-V582 PolarHBondContact O-N 2.88Å; V582-L584 PolarHBondContact O-N 3.03Å
583	D	34.5	Very low	38.7	Very low	155 Å²	155	109 Å²	109	83%	0.829	59%	0.585	S	S	*	*			trans	-43.3	112.4	-163.7	-65.3	-50.3	0	0	0	116.1	G585	D583-G585 PolarHBondContact O-N 2.84Å
584	L	29.9	Very low	36.9	Very low	99 Å²	99	115.9 Å²	115.9	52%	0.518	62%	0.616	S	S	.	*			trans	-67.2	120.6	157.4	-84.3	-176.5	0	0	0	108.7	R554 M556 V582	R554-L584 VanDerWaalsContact NH1-CD1 3.3Å; M556-L584 HydrophobicContact CE-CD1 4.06Å; M556-L584 HydrophobicContact CE-CD2 4.48Å; M556-L584 HydrophobicContact CE-CG 3.74Å; M556-L584 HydrophobicContact SD-CD1 3.12Å; M556-L584 WeakPolarHBondContact SD-CD1 3.48Å; M556-L584 HydrophobicContact SD-CD2 4.44Å; M556-L584 HydrophobicContact SD-CG 3.53Å; M556-L584 VanDerWaalsContact SD-CG 3.53Å; V582-L584 PolarHBondContact O-N 3.03Å
585	G	27.2	Very low	35.2	Very low	63 Å²	63	118.5 Å²	118.5	65%	0.649	64%	0.639	S	S	*	*			trans	-50.9	148.2	175.1	0	0	0	0	0	113.6	D583	D583-G585 PolarHBondContact O-N 2.84Å
586	S	28.4	Very low	33.5	Very low	104 Å²	104	117.3 Å²	117.3	73%	0.727	64%	0.64	S	S	*	*			trans	99.9	116.9	159.3	78	0	0	0	0	116.9
587	T	24.1	Very low	31.7	Very low	118 Å²	118	121.3 Å²	121.3	72%	0.724	66%	0.66	S	S	*	*	S	Bend	trans	95.7	118.1	154.2	81.8	0	0	0	0	116.1
588	H	23.7	Very low	30.1	Very low	161 Å²	161	128.3 Å²	128.3	75%	0.745	69%	0.692	S	S	*	*			trans	89.7	52.5	163.1	-53.7	84	0	0	0	119.4
589	V	23.6	Very low	28.7	Very low	136 Å²	136	128 Å²	128	82%	0.824	70%	0.696	S	S	*	*			trans	-123.2	66.1	133.8	-168.2	0	0	0	0	108.8	K591	V589-K591 PolarHBondContact O-N 3.36Å
590	I	22.9	Very low	27.1	Very low	160 Å²	160	133.7 Å²	133.7	82%	0.821	71%	0.711	S	S	*	*			trans	-83.4	75.9	155	-56.9	173.8	0	0	0	105.4
591	K	21.6	Very low	25.7	Very low	170 Å²	170	136.1 Å²	136.1	74%	0.739	72%	0.723	S	S	*	*	S	Bend	trans	-142.4	112.4	156.3	-78.8	-162.8	176.9	-179.5	0	108.2	V589	V589-K591 PolarHBondContact O-N 3.36Å
592	E	25.4	Very low	24.7	Very low	172 Å²	172	143.2 Å²	143.2	80%	0.804	75%	0.752	S	S	*	*			trans	71	58.8	150.5	-60.7	172	-174	0	0	117	Q594	E592-Q594 PolarHBondContact O-N 2.82Å; E592-Q594 VanDerWaalsContact O-N 3.16Å
593	F	21.5	Very low	24.1	Very low	212 Å²	212	143.9 Å²	143.9	93%	0.93	75%	0.75	S	S	*	*			trans	-79.5	78.7	144.7	-125.4	-86.2	0	0	0	108
594	Q	21.3	Very low	23.7	Very low	149 Å²	149	139.4 Å²	139.4	70%	0.696	74%	0.741	S	S	*	*			trans	-75.3	125.4	156.1	-76	-150.9	-8.3	0	0	107.4	E592 T596	E592-Q594 PolarHBondContact O-N 2.82Å; E592-Q594 VanDerWaalsContact O-N 3.16Å; Q594-T596 PolarHBondContact O-N 3.39Å
595	P	20.2	Very low	23.6	Very low	114 Å²	114	141.9 Å²	141.9	74%	0.74	75%	0.754	S	S	*	*			trans	-72.3	90.2	176.9	29.6	-32.3	0	0	0	109.1	I597	P595-I597 PolarHBondContact O-N 3.09Å
596	T	20.6	Very low	23.6	Very low	104 Å²	104	147.4 Å²	147.4	64%	0.638	76%	0.763	S	S	*	*			trans	-79	100.8	167.8	39.5	0	0	0	0	108.5	Q594 E598	Q594-T596 PolarHBondContact O-N 3.39Å; T596-E598 VanDerWaalsContact C-N 3.28Å; T596-E598 PolarHBondContact O-N 2.76Å
597	I	20.2	Very low	23.7	Very low	152 Å²	152	149.1 Å²	149.1	78%	0.779	77%	0.77	S	S	*	*			trans	-65.1	90.3	166.8	-61.4	165.8	0	0	0	106.5	P595 V599	P595-I597 PolarHBondContact O-N 3.09Å; I597-V599 HydrophobicContact CG2-CG2 4.49Å; I597-V599 PolarHBondContact O-N 3Å
598	E	21	Very low	24.1	Very low	160 Å²	160	151.8 Å²	151.8	75%	0.748	77%	0.774	S	S	*	*			trans	-90.9	97.3	173.5	-73.8	-171.4	-175.7	0	0	109.8	T596 F600	T596-E598 VanDerWaalsContact C-N 3.28Å; T596-E598 PolarHBondContact O-N 2.76Å; E598-F600 PolarHBondContact O-N 3.38Å
599	V	21.8	Very low	24.3	Very low	104 Å²	104	153.6 Å²	153.6	63%	0.63	78%	0.782	S	S	*	*			trans	-47.6	126.1	169.8	179.1	0	0	0	0	109.9	I597 H601	I597-V599 HydrophobicContact CG2-CG2 4.49Å; I597-V599 PolarHBondContact O-N 3Å; V599-H601 PolarHBondContact O-N 3.46Å; V599-H601 VanDerWaalsContact O-N 3.08Å; V599-H601 PolarHBondContact O-ND1 3.09Å
600	F	22.4	Very low	24.7	Very low	201 Å²	201	153.2 Å²	153.2	88%	0.882	78%	0.78	S	S	*	*			trans	-58.8	112.7	173.1	-72.7	-88.2	0	0	0	109.9	E598 H602	E598-F600 PolarHBondContact O-N 3.38Å; F600-H602 VanDerWaalsContact C-N 3.33Å; F600-H602 PolarHBondContact O-N 3.19Å; F600-H602 VanDerWaalsContact O-N 3.08Å
601	H	24.1	Very low	25.1	Very low	162 Å²	162	151.6 Å²	151.6	75%	0.75	77%	0.773	S	S	*	*			trans	-78.3	86.6	169.7	-67.7	71.5	0	0	0	107.9	V599 I603	V599-H601 PolarHBondContact O-N 3.46Å; V599-H601 VanDerWaalsContact O-N 3.08Å; V599-H601 PolarHBondContact O-ND1 3.09Å; H601-I603 VanDerWaalsContact C-N 3.26Å; H601-I603 HydrophobicContact CB-CG1 4.39Å; H601-I603 PolarHBondContact O-N 2.99Å
602	H	25.5	Very low	25.3	Very low	186 Å²	186	149.4 Å²	149.4	86%	0.861	78%	0.777	S	S	*	*			trans	-74.3	89.4	162.9	-133.2	-43.2	0	0	0	107	F600 G604	F600-H602 VanDerWaalsContact C-N 3.33Å; F600-H602 PolarHBondContact O-N 3.19Å; F600-H602 VanDerWaalsContact O-N 3.08Å; H602-G604 PolarHBondContact O-N 3.27Å
603	I	25.7	Very low	25.8	Very low	140 Å²	140	146.2 Å²	146.2	72%	0.718	77%	0.773	S	S	*	*			trans	-75.4	86.3	169.3	-60.5	171.1	0	0	0	106.1	H601	H601-I603 VanDerWaalsContact C-N 3.26Å; H601-I603 HydrophobicContact CB-CG1 4.39Å; H601-I603 PolarHBondContact O-N 2.99Å
604	G	27.6	Very low	26.3	Very low	61 Å²	61	141.7 Å²	141.7	63%	0.629	76%	0.763	S	S	*	*			trans	-97.9	111.8	156.9	0	0	0	0	0	107.2	H602 E606	H602-G604 PolarHBondContact O-N 3.27Å; G604-E606 VanDerWaalsContact C-N 3.28Å; G604-E606 PolarHBondContact O-N 2.77Å
605	D	26.1	Very low	26.7	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	77%	0.769	S	S	*	*			trans	-68.8	82.3	172.4	-78.4	-36.2	0	0	0	109.8
606	E	29.1	Very low	27.2	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	77%	0.769	S	S	*	*			trans	-131.7	91.3	161.9	-70.7	-167.6	176.8	0	0	108.8	G604 E608	G604-E606 VanDerWaalsContact C-N 3.28Å; G604-E606 PolarHBondContact O-N 2.77Å; E606-E608 PolarHBondContact O-N 3.37Å
607	T	29.8	Very low	27.5	Very low	141 Å²	141	145.3 Å²	145.3	87%	0.865	78%	0.782	S	S	*	*			trans	-77.8	86.3	171.6	33.6	0	0	0	0	108.6
608	E	32	Very low	28	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	79%	0.785	S	S	*	*			trans	-102.1	110.1	158.3	-73.9	-159.5	163.2	0	0	109.1	E606 V610	E606-E608 PolarHBondContact O-N 3.37Å; E608-V610 PolarHBondContact O-N 3.27Å
609	E	27.8	Very low	28.2	Very low	198 Å²	198	147.8 Å²	147.8	93%	0.925	79%	0.792	S	S	*	*			trans	-63.2	113.1	174.5	-65.1	178.1	155.2	0	0	109.9
610	V	32.9	Very low	28.4	Very low	128 Å²	128	151 Å²	151	78%	0.776	81%	0.805	S	S	*	*			trans	-121.6	119.9	170.2	-176.3	0	0	0	0	109.8	E608	E608-V610 PolarHBondContact O-N 3.27Å
611	D	29.9	Very low	28.5	Very low	127 Å²	127	146.3 Å²	146.3	68%	0.679	80%	0.797	S	S	*	*			trans	-68.1	130.2	-168	-138.2	-17.4	0	0	0	112.8	S613	D611-S613 VanDerWaalsContact C-N 3.26Å; D611-S613 PolarHBondContact O-N 3.43Å
612	P	27.4	Very low	28.5	Very low	124 Å²	124	144.6 Å²	144.6	81%	0.805	80%	0.8	S	S	*	*	S	Bend	trans	-82.1	17.2	-166.5	-8.3	26.5	0	0	0	115.7	T614	P612-T614 VanDerWaalsContact C-N 3.29Å; P612-T614 PolarHBondContact O-N 3.08Å
613	S	34.5	Very low	28.5	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	80%	0.802	S	S	*	*			trans	-84.9	11.7	-174.5	59.2	0	0	0	0	115.2	D611	D611-S613 VanDerWaalsContact C-N 3.26Å; D611-S613 PolarHBondContact O-N 3.43Å
614	T	32.6	Very low	28.3	Very low	117 Å²	117	149.8 Å²	149.8	72%	0.718	81%	0.809	S	S	*	*			trans	-119.9	22.3	-167.2	-15.2	0	0	0	0	116.6	P612	P612-T614 VanDerWaalsContact C-N 3.29Å; P612-T614 PolarHBondContact O-N 3.08Å
615	I	30.1	Very low	28	Very low	160 Å²	160	153.6 Å²	153.6	82%	0.821	82%	0.82	S	S	*	*			trans	-114.8	109	171.3	-54.6	-179.4	0	0	0	109.5
616	P	29.9	Very low	28	Very low	113 Å²	113	153.7 Å²	153.7	73%	0.734	82%	0.82	S	S	*	*			trans	-78.2	135.3	-174.6	-11.3	27.5	0	0	0	113.9	E618	P616-E618 PolarHBondContact O-N 2.86Å
617	D	28	Very low	27.8	Very low	170 Å²	170	150.3 Å²	150.3	91%	0.909	82%	0.816	S	S	*	*			trans	-69.7	83.1	173.3	-76.6	-41.1	0	0	0	112.6
618	E	29.8	Very low	27.8	Very low	180 Å²	180	149.3 Å²	149.3	84%	0.841	81%	0.812	S	S	*	*			trans	-133.4	55.3	171.5	-81.6	-163.3	157.1	0	0	112.9	P616	P616-E618 PolarHBondContact O-N 2.86Å
619	M	26.1	Very low	27.6	Very low	184 Å²	184	147.3 Å²	147.3	91%	0.906	81%	0.814	S	S	*	*			trans	-145.1	43.3	165.1	-74	-155.4	72.9	0	0	113.7
620	L	25	Very low	27.4	Very low	172 Å²	172	141 Å²	141	90%	0.901	80%	0.802	S	S	*	*			trans	-141.8	83.1	169.7	-73.1	174.3	0	0	0	112.2
621	S	24.7	Very low	26.8	Very low	101 Å²	101	143.4 Å²	143.4	71%	0.706	80%	0.803	S	S	*	*			trans	-176.6	147.1	132.5	49.5	0	0	0	0	112.5
622	P	25.1	Very low	26.6	Very low	126 Å²	126	143.7 Å²	143.7	82%	0.818	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-91.8	121	-166.4	26.5	-13.7	0	0	0	112	R624	P622-R624 PolarHBondContact O-N 3.46Å
623	F	24.8	Very low	26.4	Very low	206 Å²	206	144.7 Å²	144.7	90%	0.904	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.5	122.3	178.9	-83.3	-87.7	0	0	0	112.4
624	R	21	Very low	26	Very low	230 Å²	230	145 Å²	145	87%	0.868	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-58.4	134.8	172.8	-106.1	174.5	171.5	169.3	-3	112.2	P622 N626	P622-R624 PolarHBondContact O-N 3.46Å; R624-N626 PolarHBondContact O-N 2.82Å
625	V	22.6	Very low	25.9	Very low	140 Å²	140	144.5 Å²	144.5	85%	0.848	81%	0.81	S	S	*	*			trans	-63.4	112.7	167.3	178.7	0	0	0	0	109.6
626	N	26.1	Very low	25.7	Very low	153 Å²	153	145.1 Å²	145.1	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-98	123.4	163.8	-80.1	-28.9	0	0	0	108.8	R624	R624-N626 PolarHBondContact O-N 2.82Å
627	S	24.4	Very low	25.2	Very low	107 Å²	107	148 Å²	148	75%	0.748	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-66.5	155.3	-179.4	44.2	0	0	0	0	113.5
628	P	28.6	Very low	25	Very low	121 Å²	121	145.1 Å²	145.1	79%	0.786	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86.2	154.2	-165.2	18.4	-4.7	0	0	0	114.2
629	P	28.1	Very low	24.9	Very low	131 Å²	131	143.7 Å²	143.7	85%	0.851	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-82	141.5	178.4	31.9	-31.1	0	0	0	112.3
630	G	23.6	Very low	24.7	Very low	65 Å²	65	142 Å²	142	67%	0.67	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-83.3	155.7	-175.1	0	0	0	0	0	116.1
631	F	21.4	Very low	24.8	Very low	180 Å²	180	144 Å²	144	79%	0.789	80%	0.798	S	S	*	*			trans	29.7	133.8	147	-71.2	-86	0	0	0	121	L633	F631-L633 HydrophobicContact CD1-CG 4.47Å
632	P	25.9	Very low	24.8	Very low	132 Å²	132	143.9 Å²	143.9	86%	0.857	80%	0.797	S	S	*	*				-124.8	130.5	119.3	17.8	0.7	0	0	0	112.7
633	L	22.7	Very low	24.8	Very low	146 Å²	146	145.4 Å²	145.4	76%	0.764	80%	0.798	S	S	*	*			trans	-71.5	141	163.1	-66.7	146.4	0	0	0	108.2	F631	F631-L633 HydrophobicContact CD1-CG 4.47Å
634	S	25.2	Very low	24.9	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	79%	0.786	S	S	*	*				160.3	167.2	76	47.1	0	0	0	0	108.5
635	P	30.9	Very low	25.1	Very low	106 Å²	106	141.6 Å²	141.6	69%	0.688	79%	0.791	S	S	*	*			trans	-108	151.2	-157	38.2	-28.7	0	0	0	114.8
636	D	25	Very low	25.2	Very low	172 Å²	172	140.1 Å²	140.1	92%	0.92	78%	0.782	S	S	*	*			trans	-99.1	140.2	170.2	-87.3	-32.5	0	0	0	113.2
637	F	20.9	Very low	25.2	Very low	175 Å²	175	144.8 Å²	144.8	77%	0.768	79%	0.788	S	S	*	*			trans	-82.8	148.2	-169.9	-89.7	-106.5	0	0	0	114.2
638	T	24	Very low	25.2	Very low	108 Å²	108	148.1 Å²	148.1	66%	0.663	79%	0.792	S	S	*	*			trans	61.9	120.2	137.8	58.8	0	0	0	0	121.7
639	N	26.4	Very low	25.2	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	80%	0.796	S	S	*	*				-179	99.7	123.1	-92.5	-39.3	0	0	0	108.8
640	L	22.6	Very low	24.9	Very low	150 Å²	150	147.8 Å²	147.8	79%	0.785	80%	0.796	S	S	*	*				42.5	103.6	98.3	-78.6	167.8	0	0	0	115
641	K	27.4	Very low	24.9	Very low	214 Å²	214	148 Å²	148	93%	0.93	80%	0.798	S	S	*	*			trans	-155.4	98.8	140.4	-107.6	175.2	-172.6	179.9	0	110
642	S	24.6	Very low	25.3	Very low	97 Å²	97	147.9 Å²	147.9	68%	0.678	80%	0.804	S	S	*	*			trans	-81.8	136	159.2	47.7	0	0	0	0	109.4
643	D	25.3	Very low	25.2	Very low	158 Å²	158	146.1 Å²	146.1	85%	0.845	80%	0.795	S	S	*	*				-169.9	148	117.4	-112.9	-12	0	0	0	113.1
644	P	26.9	Very low	25.3	Very low	100 Å²	100	146.8 Å²	146.8	65%	0.649	80%	0.8	S	S	*	*			trans	-99	156.5	-168	39	-33	0	0	0	113
645	R	24.4	Very low	25.5	Very low	256 Å²	256	147.1 Å²	147.1	97%	0.966	80%	0.799	S	S	*	*			trans	-121.9	101.3	159	-69.5	-177.1	-162.2	166.1	6.2	108.8
646	V	25.9	Very low	25.8	Very low	110 Å²	110	148 Å²	148	67%	0.667	81%	0.805	S	S	*	*			trans	-114	122.5	164	176.2	0	0	0	0	106.7
647	R	25.1	Very low	26	Very low	251 Å²	251	146 Å²	146	95%	0.947	80%	0.798	S	S	*	*			trans	-135.5	121.5	153.6	-87.3	-167.2	-179.1	179.9	1	108.8
648	H	25.4	Very low	26.3	Very low	176 Å²	176	142.5 Å²	142.5	82%	0.815	80%	0.796	S	S	*	*			trans	-71.4	144.3	170.4	-67.2	-94.4	0	0	0	110.8
649	S	26.7	Very low	26.3	Very low	126 Å²	126	144.7 Å²	144.7	88%	0.881	80%	0.804	S	S	*	*			trans	-151.4	124	138.7	53	0	0	0	0	109.7
650	S	22.5	Very low	26.4	Very low	120 Å²	120	143.2 Å²	143.2	84%	0.839	80%	0.803	S	S	*	*			trans	-108.2	145.9	178.8	47.9	0	0	0	0	109.2
651	G	24.2	Very low	26.4	Very low	69 Å²	69	141.8 Å²	141.8	71%	0.711	81%	0.805	S	S	*	*			trans	121	110.2	153.6	0	0	0	0	0	115.2
652	L	29.1	Very low	26.6	Very low	178 Å²	178	136.5 Å²	136.5	93%	0.932	80%	0.801	S	S	*	*				178.6	117.3	115.5	-94.6	152.1	0	0	0	110.1
653	S	24	Very low	26.5	Very low	95 Å²	95	140.8 Å²	140.8	66%	0.664	81%	0.813	S	S	*	*			trans	-79.6	143.3	170.2	48.9	0	0	0	0	111.5
654	N	25	Very low	26.5	Very low	160 Å²	160	138.1 Å²	138.1	86%	0.856	80%	0.804	S	S	*	*			trans	-165.7	128.5	142.7	-90.7	-19.8	0	0	0	109.7
655	P	29.3	Very low	26.5	Very low	118 Å²	118	139.2 Å²	139.2	77%	0.766	81%	0.811	S	S	*	*			trans	-106.4	-167.9	172.7	46.3	-35.9	0	0	0	110.2
656	P	37.4	Very low	26.4	Very low	125 Å²	125	133.3 Å²	133.3	81%	0.812	80%	0.804	S	S	*	*				-115.2	165.1	-111.8	29.2	-7.4	0	0	0	115
657	T	28.2	Very low	26.3	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	81%	0.811	S	S	*	*			trans	-133.5	121.7	174	52.6	0	0	0	0	112
658	S	27.1	Very low	26.1	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	80%	0.798	S	S	*	*			trans	11.1	147.2	137.5	57	0	0	0	0	118.8
659	D	25.8	Very low	25.9	Very low	153 Å²	153	127 Å²	127	82%	0.818	80%	0.795	S	S	*	*			cis	-172	168.4	1.8	-117.9	-22.7	0	0	0	105.8
660	P	26.5	Very low	25.7	Very low	120 Å²	120	128 Å²	128	78%	0.779	79%	0.789	S	S	*	*			trans	-96.1	128.7	-174.2	35	-28.3	0	0	0	113.5
661	S	24.4	Very low	25.6	Very low	119 Å²	119	130 Å²	130	83%	0.832	79%	0.788	S	S	*	*			trans	-158.6	106.4	162.7	67.9	0	0	0	0	112.1
662	A	30.2	Very low	25.5	Very low	104 Å²	104	136.3 Å²	136.3	86%	0.86	79%	0.792	S	S	*	*			trans	-169	116.5	148.4	0	0	0	0	0	109.7
663	M	22.1	Very low	25.2	Very low	186 Å²	186	130.8 Å²	130.8	92%	0.916	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-63.7	166.3	179.8	-105.2	-170.7	165.3	0	0	114.4
664	P	25.7	Very low	25.2	Very low	102 Å²	102	134.3 Å²	134.3	66%	0.662	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-85.1	157.6	-167.4	35.5	-34.9	0	0	0	113.7
665	P	27.7	Very low	25	Very low	124 Å²	124	133.4 Å²	133.4	81%	0.805	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.7	125.1	172.4	31.4	-29.8	0	0	0	111.3
666	V	21.4	Very low	24.8	Very low	132 Å²	132	132.3 Å²	132.3	80%	0.8	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-80.7	121.4	166.6	172.8	0	0	0	0	108.2
667	L	24.2	Very low	24.1	Very low	156 Å²	156	135.6 Å²	135.6	82%	0.817	79%	0.787	S	S	*	*			trans	-157.9	95.8	162.3	-108.8	139.3	0	0	0	112.3
668	I	21.6	Very low	23.8	Very low	133 Å²	133	137.4 Å²	137.4	68%	0.682	79%	0.791	S	S	*	*			trans	45.8	125.9	133.9	-52.2	175.5	0	0	0	119.1
669	P	20.5	Very low	23.7	Very low	114 Å²	114	138 Å²	138	74%	0.74	79%	0.792	S	S	*	*			trans	-80.2	126.7	-179.3	31.1	-28.7	0	0	0	112.5
670	I	23	Very low	23.6	Very low	149 Å²	149	138.9 Å²	138.9	76%	0.764	79%	0.792	S	S	*	*			trans	-92.6	108.6	172.1	-62.7	174.4	0	0	0	108.5	Y672	I670-Y672 HydrophobicContact CG2-CD2 3.94Å; I670-Y672 PolarHBondContact O-N 3.39Å
671	I	19.7	Very low	23.4	Very low	161 Å²	161	139 Å²	139	83%	0.826	79%	0.792	S	S	*	*			trans	-73.4	107	163.7	-62.1	168.9	0	0	0	106.7
672	Y	23.6	Very low	23.4	Very low	201 Å²	201	138.8 Å²	138.8	79%	0.788	79%	0.786	S	S	*	*			trans	-130.9	111.5	159.5	-114.4	-87.8	0	0	0	108	I670	I670-Y672 HydrophobicContact CG2-CD2 3.94Å; I670-Y672 PolarHBondContact O-N 3.39Å
673	G	21.3	Very low	23	Very low	62 Å²	62	140.2 Å²	140.2	64%	0.639	78%	0.778	S	S	*	*			trans	-67	137.7	163.2	0	0	0	0	0	109.5
674	Q	24.9	Very low	23	Very low	169 Å²	169	139.2 Å²	139.2	79%	0.79	77%	0.769	S	S	*	*			trans	-171.4	103.8	149.7	-106.7	173	12.3	0	0	109.5	A676	Q674-A676 PolarHBondContact O-N 3.05Å
675	T	21.1	Very low	23	Very low	141 Å²	141	139.1 Å²	139.1	87%	0.865	77%	0.768	S	S	*	*			trans	27.8	71	133.6	60.1	0	0	0	0	116.7
676	A	24.3	Very low	22.8	Very low	95 Å²	95	140.4 Å²	140.4	79%	0.785	77%	0.768	S	S	*	*			trans	-87.4	111.5	160.3	0	0	0	0	0	107.9	Q674 L678	Q674-A676 PolarHBondContact O-N 3.05Å; A676-L678 PolarHBondContact O-N 3.03Å
677	K	23.7	Very low	23	Very low	195 Å²	195	144.4 Å²	144.4	85%	0.848	77%	0.77	S	S	*	*			trans	-33.8	124.3	168.6	-76.3	172.7	169.7	179	0	110.6	P679	K677-P679 VanDerWaalsContact O-CD 3.28Å; K677-P679 WeakPolarHBondContact O-CD 3.25Å; K677-P679 VanDerWaalsContact O-N 3.15Å
678	L	21.4	Very low	22.9	Very low	166 Å²	166	140.2 Å²	140.2	87%	0.869	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-52.1	119.3	160.5	-106.2	90.1	0	0	0	107.2	A676	A676-L678 PolarHBondContact O-N 3.03Å
679	P	24.8	Very low	22.9	Very low	116 Å²	116	143.4 Å²	143.4	75%	0.753	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-71	133.2	166.5	27.9	-25.3	0	0	0	107.5	K677	K677-P679 VanDerWaalsContact O-CD 3.28Å; K677-P679 WeakPolarHBondContact O-CD 3.25Å; K677-P679 VanDerWaalsContact O-N 3.15Å
680	E	22.7	Very low	23.1	Very low	172 Å²	172	143.9 Å²	143.9	80%	0.804	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-46.9	142.9	174.4	-69	171.1	167.8	0	0	111.1	V682	E680-V682 VanDerWaalsContact C-N 3.33Å; E680-V682 PolarHBondContact O-N 3.23Å
681	P	22.6	Very low	23.2	Very low	122 Å²	122	144.6 Å²	144.6	79%	0.792	76%	0.763	S	S	*	*			trans	-70.3	92.6	-176.7	30.1	-32.5	0	0	0	108.6	L683	P681-L683 VanDerWaalsContact C-N 3.28Å; P681-L683 PolarHBondContact O-N 3.48Å
682	V	25.2	Very low	23.3	Very low	115 Å²	115	142.7 Å²	142.7	70%	0.697	76%	0.764	S	S	*	*			trans	-62.8	100.8	160.5	-173.9	0	0	0	0	105.3	E680 K684	E680-V682 VanDerWaalsContact C-N 3.33Å; E680-V682 PolarHBondContact O-N 3.23Å; V682-K684 HydrophobicContact CG1-CG 3.77Å; V682-K684 PolarHBondContact O-N 3.34Å
683	L	22.4	Very low	23.3	Very low	133 Å²	133	141 Å²	141	70%	0.696	77%	0.765	S	S	*	*			trans	-58.6	71.3	163.7	-77.6	161.3	0	0	0	108	P681 P685	P681-L683 VanDerWaalsContact C-N 3.28Å; P681-L683 PolarHBondContact O-N 3.48Å; L683-P685 WeakPolarHBondContact O-CD 3.29Å
684	K	22	Very low	23.5	Very low	165 Å²	165	141 Å²	141	72%	0.717	77%	0.766	S	S	*	*			trans	-70.4	123.3	161.2	-73.3	-170.4	177.2	179.1	0	104.9	V682 L686	V682-K684 HydrophobicContact CG1-CG 3.77Å; V682-K684 PolarHBondContact O-N 3.34Å; K684-L686 PolarHBondContact O-N 3.28Å
685	P	23.8	Very low	23.3	Very low	101 Å²	101	139 Å²	139	66%	0.656	77%	0.765	S	S	*	*			trans	-50.4	120.8	166	-17.7	28.7	0	0	0	106	L683 Y687	L683-P685 WeakPolarHBondContact O-CD 3.29Å; P685-Y687 HydrophobicContact CB-CD2 4.28Å; P685-Y687 HydrophobicContact CB-CE2 4.34Å; P685-Y687 PolarHBondContact O-N 3.1Å
686	L	24.1	Very low	23.5	Very low	151 Å²	151	138.1 Å²	138.1	79%	0.791	76%	0.762	S	S	*	*			trans	-64.8	78.7	178.3	-78.7	160.7	0	0	0	108.5	K684 S688	K684-L686 PolarHBondContact O-N 3.28Å; L686-S688 PolarHBondContact O-N 2.81Å
687	Y	25.7	Very low	23.5	Very low	216 Å²	216	142.4 Å²	142.4	85%	0.847	76%	0.763	S	S	*	*			trans	-75.7	46.8	149.9	-74	-80	0	0	0	108.3	P685 K689	P685-Y687 HydrophobicContact CB-CD2 4.28Å; P685-Y687 HydrophobicContact CB-CE2 4.34Å; P685-Y687 PolarHBondContact O-N 3.1Å; Y687-K689 PolarHBondContact O-N 3.23Å
688	S	22.1	Very low	23.6	Very low	68 Å²	68	138.4 Å²	138.4	48%	0.476	76%	0.757	S	S	.	*			trans	-84.1	91.3	171.6	58	0	0	0	0	107.6	L686 V690	L686-S688 PolarHBondContact O-N 2.81Å; S688-V690 PolarHBondContact O-N 2.99Å
689	K	22.8	Very low	24	Very low	199 Å²	199	136 Å²	136	87%	0.865	75%	0.749	S	S	*	*			trans	26.1	58.2	152.1	-80.9	177	170.3	174.1	0	114.6	Y687 H691	Y687-K689 PolarHBondContact O-N 3.23Å; K689-H691 PolarHBondContact O-N 2.72Å; K689-H691 VanDerWaalsContact O-N 3.13Å
690	V	23.4	Very low	24.4	Very low	125 Å²	125	134.7 Å²	134.7	76%	0.758	75%	0.748	S	S	*	*			trans	-70.2	117.4	167.4	-176.7	0	0	0	0	104	S688 S692	S688-V690 PolarHBondContact O-N 2.99Å; V690-S692 PolarHBondContact O-N 3.28Å
691	H	25.3	Very low	25.2	Very low	163 Å²	163	129.4 Å²	129.4	76%	0.755	73%	0.727	S	S	*	*			trans	-42.8	135.7	169.2	-70.8	15.9	0	0	0	107.5	K689 M693	K689-H691 PolarHBondContact O-N 2.72Å; K689-H691 VanDerWaalsContact O-N 3.13Å; H691-M693 PolarHBondContact O-N 3.35Å
692	S	22.6	Very low	26.1	Very low	121 Å²	121	129.2 Å²	129.2	85%	0.846	73%	0.729	S	S	*	*			trans	-60.9	75.9	-180	59.8	0	0	0	0	110.5	V690 G694	V690-S692 PolarHBondContact O-N 3.28Å; S692-G694 PolarHBondContact O-N 3.3Å; S692-G694 VanDerWaalsContact O-N 3.13Å
693	M	23.7	Very low	27.1	Very low	165 Å²	165	130.1 Å²	130.1	81%	0.813	72%	0.72	S	S	*	*			trans	-62.7	106.5	154.7	-72.6	-94.2	-94.6	0	0	102.6	H691 T695	H691-M693 PolarHBondContact O-N 3.35Å; M693-T695 PolarHBondContact O-N 3.47Å
694	G	23.7	Very low	28.4	Very low	64 Å²	64	125.9 Å²	125.9	66%	0.66	70%	0.697	S	S	*	*			trans	-46.8	123.1	-179.2	0	0	0	0	0	108	S692 P696	S692-G694 PolarHBondContact O-N 3.3Å; S692-G694 VanDerWaalsContact O-N 3.13Å; G694-P696 WeakPolarHBondContact O-CD 3.46Å
695	T	22.1	Very low	29.4	Very low	126 Å²	126	119.6 Å²	119.6	77%	0.773	67%	0.674	S	S	*	*			trans	-46.9	114.3	173.5	48.6	0	0	0	0	106.7	M693 K697	M693-T695 PolarHBondContact O-N 3.47Å; T695-K697 PolarHBondContact O-N 3.01Å
696	P	25.6	Very low	30.5	Very low	122 Å²	122	122.2 Å²	122.2	79%	0.792	69%	0.687	S	S	*	*			trans	-53.4	122.9	168	-16.7	28.6	0	0	0	104.5	G694	G694-P696 WeakPolarHBondContact O-CD 3.46Å
697	K	23.2	Very low	31.8	Very low	186 Å²	186	119.7 Å²	119.7	81%	0.809	67%	0.667	S	S	*	*			trans	-49.2	133.3	172	-79.9	179.7	175.3	179.7	0	106.1	T695 T699	T695-K697 PolarHBondContact O-N 3.01Å; K697-T699 VanDerWaalsContact C-N 3.34Å; K697-T699 PolarHBondContact O-N 3.39Å
698	P	26.8	Very low	33.1	Very low	111 Å²	111	117.1 Å²	117.1	72%	0.721	67%	0.668	S	S	*	*			trans	-54.3	108.9	173.8	21.9	-29.8	0	0	0	105.9	A700	P698-A700 PolarHBondContact O-N 3.46Å
699	T	30.4	Very low	34.9	Very low	115 Å²	115	118.7 Å²	118.7	71%	0.706	66%	0.664	S	S	*	*			trans	-52.1	117.9	163.4	40.4	0	0	0	0	103.8	K697 V701	K697-T699 VanDerWaalsContact C-N 3.34Å; K697-T699 PolarHBondContact O-N 3.39Å; T699-V701 PolarHBondContact O-N 3.3Å
700	A	31.2	Very low	36.9	Very low	88 Å²	88	118.9 Å²	118.9	73%	0.727	66%	0.659	S	S	*	*			trans	-41	115.4	-176.9	0	0	0	0	0	108	P698 S702	P698-A700 PolarHBondContact O-N 3.46Å; A700-S702 PolarHBondContact O-N 2.97Å
701	V	39.4	Very low	39.3	Very low	61 Å²	61	114.6 Å²	114.6	37%	0.37	63%	0.631	S	S	.	*			trans	-65.5	89.3	-177.5	-172.5	0	0	0	0	105.2	T699 W703 I704	T699-V701 PolarHBondContact O-N 3.3Å; V701-W703 PolarHBondContact O-N 2.95Å; V701-I704 HydrophobicContact CG1-CD1 3.89Å; V701-I704 HydrophobicContact CG1-CG1 3.79Å
702	S	42	Very low	41.6	Very low	119 Å²	119	114 Å²	114	83%	0.832	63%	0.631	S	S	*	*			trans	-81.9	0.5	-168.3	63.6	0	0	0	0	112.1	A700	A700-S702 PolarHBondContact O-N 2.97Å
703	W	47.1	Very low	44.2	Very low	133 Å²	133	109.1 Å²	109.1	50%	0.504	60%	0.596	S	S	.	*			trans	-142.7	77.8	-173.5	-158	83	0	0	0	110.2	V701 P705 E766 L809	V701-W703 PolarHBondContact O-N 2.95Å; W703-P705 HydrophobicContact CD2-CG 4.25Å; W703-P705 HydrophobicContact CE3-CG 4.28Å; W703-P705 HydrophobicContact CH2-CG 3.95Å; W703-P705 HydrophobicContact CZ2-CG 3.89Å; W703-P705 HydrophobicContact CZ3-CG 4.14Å; W703-E766 WeakPolarHBondContact CH2-OE1 3.28Å; W703-L809 HydrophobicContact CZ3-CD1 4.27Å
704	I	48.5	Very low	47.1	Very low	44 Å²	44	104 Å²	104	23%	0.226	58%	0.577	C	S	.	*			trans	-116.6	107.5	152.6	-60	171.7	0	0	0	104.6	V701 V706 A770 H773	V701-I704 HydrophobicContact CG1-CD1 3.89Å; V701-I704 HydrophobicContact CG1-CG1 3.79Å; I704-V706 PolarHBondContact O-N 3.35Å; I704-V706 VanDerWaalsContact O-N 3.14Å; I704-A770 HydrophobicContact CG2-CB 3.39Å; I704-H773 HydrophobicContact CD1-CB 3.72Å; I704-H773 VanDerWaalsContact CD1-ND1 3.31Å; I704-H773 WeakPolarHBondContact CD1-ND1 3.45Å
705	P	43.6	Very low	49.9	Very low	34 Å²	34	107.2 Å²	107.2	22%	0.221	58%	0.579	C	S	.	*			trans	-56.4	120.5	177.6	-23.4	33.1	0	0	0	109.5	W703 R707	W703-P705 HydrophobicContact CD2-CG 4.25Å; W703-P705 HydrophobicContact CE3-CG 4.28Å; W703-P705 HydrophobicContact CH2-CG 3.95Å; W703-P705 HydrophobicContact CZ2-CG 3.89Å; W703-P705 HydrophobicContact CZ3-CG 4.14Å; P705-R707 HydrophobicContact CB-CG 3.71Å; P705-R707 PolarHBondContact O-N 3.36Å
706	V	47.2	Very low	52.9	Low	155 Å²	155	107.4 Å²	107.4	94%	0.939	57%	0.57	S	S	*	*			trans	-67.1	90.2	165.6	-173.4	0	0	0	0	106.2	I704	I704-V706 PolarHBondContact O-N 3.35Å; I704-V706 VanDerWaalsContact O-N 3.14Å
707	R	51.1	Low	55.7	Low	99 Å²	99	101.6 Å²	101.6	37%	0.374	53%	0.533	S	S	.	.			trans	-114.7	147.9	178.4	-74.4	177.8	-176.8	159.7	5.9	108.7	P705 Y709 E766	P705-R707 HydrophobicContact CB-CG 3.71Å; P705-R707 PolarHBondContact O-N 3.36Å; R707-Y709 PolarHBondContact O-N 3.41Å; R707-E766 IonicContact CZ-OE2 4Å; R707-E766 IonicContact NH1-OE2 2.83Å; R707-E766 PolarHBondContact NH1-OE2 2.62Å; R707-E766 IonicContact NH2-OE2 2.74Å
708	N	53.8	Low	58.6	Low	161 Å²	161	97.3 Å²	97.3	86%	0.861	51%	0.514	S	S	*	.			trans	-63.2	107	156.4	-75.1	-18.6	0	0	0	106.4	R710	N708-R710 PolarHBondContact O-N 3.08Å; N708-R710 VanDerWaalsContact O-N 3.16Å
709	Y	59.5	Low	61.3	Low	102 Å²	102	99.1 Å²	99.1	40%	0.4	51%	0.511	S	S	.	.			trans	-54.3	122.9	-177.9	-45.3	-75.6	0	0	0	109.2	R707 D767 A770 I771 D774	R707-Y709 PolarHBondContact O-N 3.41Å; Y709-D767 HydrophobicContact CD1-CB 4.34Å; Y709-A770 HydrophobicContact CD1-CB 4.47Å; Y709-A770 HydrophobicContact CE1-CB 3.86Å; Y709-I771 HydrophobicContact CD1-CD1 4.08Å; Y709-I771 HydrophobicContact CD1-CG1 3.56Å; Y709-I771 HydrophobicContact CD2-CG1 4.16Å; Y709-I771 HydrophobicContact CE1-CG1 3.64Å; Y709-I771 HydrophobicContact CE2-CG1 4.24Å; Y709-I771 HydrophobicContact CG-CD1 4.04Å; Y709-I771 HydrophobicContact CG-CG1 3.83Å; Y709-D774 PolarHBondContact OH-OD2 3.08Å
710	R	64.7	Low	63.9	Low	202 Å²	202	93.8 Å²	93.8	76%	0.762	48%	0.479	S	S	*	.	S	Bend	trans	-80.7	-32.2	169.6	-71.2	-166.8	-176.6	167.9	-3.5	110.1	N708 I712 D767	N708-R710 PolarHBondContact O-N 3.08Å; N708-R710 VanDerWaalsContact O-N 3.16Å; R710-I712 PolarHBondContact O-N 2.93Å; R710-D767 PolarHBondContact N-OD2 3.41Å
711	F	73.6	Confident	66.4	Low	36 Å²	36	89.6 Å²	89.6	16%	0.158	44%	0.444	C	S	.	.	S	Bend	trans	-70.8	118.4	173.6	-174.6	-101.2	0	0	0	110.7	L713 I750 L754 D767 F768 I771	F711-L713 HydrophobicContact CD1-CG 4.43Å; F711-L713 HydrophobicContact CE1-CD2 3.95Å; F711-L713 HydrophobicContact CE1-CG 4.01Å; F711-I750 HydrophobicContact CZ-CG2 4.2Å; F711-L754 HydrophobicContact CE2-CD1 4.1Å; F711-L754 HydrophobicContact CE2-CD2 4.14Å; F711-L754 HydrophobicContact CZ-CD1 3.96Å; F711-D767 HydrophobicContact CB-CB 3.52Å; F711-D767 PolarHBondContact N-OD2 3.27Å; F711-F768 HydrophobicContact CD1-CB 4.43Å; F711-F768 HydrophobicContact CE1-CB 4.4Å; F711-F768 AromaticContact CE1-CD2 3.85Å; F711-F768 HydrophobicContact CE1-CD2 3.85Å; F711-F768 HydrophobicContact CZ-CD2 4.44Å; F711-I771 HydrophobicContact CD1-CD1 4.27Å
712	I	73.7	Confident	68.5	Low	149 Å²	149	91.4 Å²	91.4	76%	0.764	45%	0.448	S	S	*	.			trans	-99.1	111.5	175.3	-58.5	174.1	0	0	0	107.5	R710 S714	R710-I712 PolarHBondContact O-N 2.93Å; I712-S714 PolarHBondContact O-N 3.12Å
713	L	76.5	Confident	70.3	Confident	20 Å²	20	87.6 Å²	87.6	11%	0.105	42%	0.422	C	S	.	.			trans	-55.9	139.5	169.9	-81.4	159.9	0	0	0	110.3	F711 A717 F768 I771 Y775	F711-L713 HydrophobicContact CD1-CG 4.43Å; F711-L713 HydrophobicContact CE1-CD2 3.95Å; F711-L713 HydrophobicContact CE1-CG 4.01Å; L713-A717 HydrophobicContact CB-CB 4.42Å; L713-A717 HydrophobicContact CD2-CB 3.74Å; L713-F768 HydrophobicContact CD2-CD2 3.96Å; L713-F768 HydrophobicContact CD2-CE2 3.87Å; L713-I771 HydrophobicContact CD1-CB 4.19Å; L713-I771 HydrophobicContact CD1-CD1 3.98Å; L713-I771 HydrophobicContact CD1-CG2 3.33Å; L713-I771 HydrophobicContact CG-CD1 4.22Å; L713-Y775 HydrophobicContact CD1-CE2 4.46Å
714	S	84.9	Confident	72	Confident	58 Å²	58	81.4 Å²	81.4	41%	0.406	40%	0.398	S	S	.	.			trans	-57.9	148.1	170.4	73.9	0	0	0	0	110.2	I712 E716 A717 K718	I712-S714 PolarHBondContact O-N 3.12Å; S714-E716 PolarHBondContact O-N 2.82Å; S714-E716 VanDerWaalsContact O-N 3.1Å; S714-A717 PolarHBondContact O-N 2.82Å; S714-A717 WeakPolarHBondContact OG-CB 3.47Å; S714-A717 PolarHBondContact OG-N 3.15Å; S714-A717 VanDerWaalsContact OG-N 3.16Å; S714-K718 PolarHBondContact O-N 3.15Å
715	N	82.5	Confident	73.4	Confident	131 Å²	131	81.1 Å²	81.1	70%	0.701	40%	0.397	S	S	*	.	H	α-helix	trans	-56.9	-29.9	178.6	-74.6	-27.2	0	0	0	112.4	K719	N715-K719 VanDerWaalsContact O-CG 3.32Å; N715-K719 WeakPolarHBondContact O-CG 3.41Å; N715-K719 PolarHBondContact O-N 3.32Å
716	E	85.4	Confident	74.7	Confident	129 Å²	129	81.1 Å²	81.1	60%	0.603	40%	0.403	S	S	*	.	H	α-helix	trans	-68.3	-46.2	174.3	-168.2	-178.3	167.5	0	0	111.7	S714 K718 K719 A720 T746	S714-E716 PolarHBondContact O-N 2.82Å; S714-E716 VanDerWaalsContact O-N 3.1Å; E716-K718 PolarHBondContact O-N 3.1Å; E716-K719 PolarHBondContact O-N 2.98Å; E716-A720 WeakPolarHBondContact O-CB 3.2Å; E716-A720 PolarHBondContact O-N 3.38Å; E716-T746 HydrophobicContact CG-CG2 4.19Å
717	A	84.6	Confident	75.9	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-64.5	-39.4	177.3	0	0	0	0	0	112.3	L713 S714 A720 C721 L747 I750	L713-A717 HydrophobicContact CB-CB 4.42Å; L713-A717 HydrophobicContact CD2-CB 3.74Å; S714-A717 PolarHBondContact O-N 2.82Å; S714-A717 WeakPolarHBondContact OG-CB 3.47Å; S714-A717 PolarHBondContact OG-N 3.15Å; S714-A717 VanDerWaalsContact OG-N 3.16Å; A717-A720 WeakPolarHBondContact O-CB 3.45Å; A717-A720 PolarHBondContact O-N 3.02Å; A717-C721 PolarHBondContact O-N 2.86Å; A717-C721 PolarHBondContact O-SG 3.4Å; A717-C721 VanDerWaalsContact O-SG 3.41Å; A717-L747 HydrophobicContact CB-CD2 3.97Å; A717-I750 HydrophobicContact CB-CD1 3.47Å; A717-I750 VanDerWaalsContact CB-CD1 3.47Å
718	K	84	Confident	76.9	Confident	97 Å²	97	74.3 Å²	74.3	42%	0.422	36%	0.361	S	S	.	.	H	α-helix	trans	-60.5	-47.1	174.9	-171.9	178.2	177.3	-179.5	0	111.7	S714 E716 A720 C721 E722	S714-K718 PolarHBondContact O-N 3.15Å; E716-K718 PolarHBondContact O-N 3.1Å; K718-A720 VanDerWaalsContact C-N 3.29Å; K718-A720 PolarHBondContact O-N 3.45Å; K718-C721 PolarHBondContact O-N 3.07Å; K718-E722 VanDerWaalsContact CE-OE1 3.27Å; K718-E722 WeakPolarHBondContact CE-OE1 3.34Å; K718-E722 WeakPolarHBondContact O-CG 3.38Å; K718-E722 PolarHBondContact O-N 3.1Å
719	K	84.5	Confident	77.6	Confident	148 Å²	148	74.2 Å²	74.2	64%	0.643	36%	0.356	S	S	*	.	H	α-helix	trans	-62.9	-34.8	174.6	-73	176.1	-179.2	-177.7	0	112.4	N715 E716 S723	N715-K719 VanDerWaalsContact O-CG 3.32Å; N715-K719 WeakPolarHBondContact O-CG 3.41Å; N715-K719 PolarHBondContact O-N 3.32Å; E716-K719 PolarHBondContact O-N 2.98Å; K719-S723 WeakPolarHBondContact O-CB 3.35Å; K719-S723 PolarHBondContact O-N 3.03Å
720	A	84.3	Confident	77.7	Confident	4 Å²	4	71.6 Å²	71.6	3%	0.033	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-48.8	174.3	0	0	0	0	0	111.2	E716 A717 K718 S723 L724 K743 L747	E716-A720 WeakPolarHBondContact O-CB 3.2Å; E716-A720 PolarHBondContact O-N 3.38Å; A717-A720 WeakPolarHBondContact O-CB 3.45Å; A717-A720 PolarHBondContact O-N 3.02Å; K718-A720 VanDerWaalsContact C-N 3.29Å; K718-A720 PolarHBondContact O-N 3.45Å; A720-S723 PolarHBondContact O-N 3.13Å; A720-L724 WeakPolarHBondContact O-CB 3.39Å; A720-L724 VanDerWaalsContact O-CG 3.26Å; A720-L724 WeakPolarHBondContact O-CG 3.46Å; A720-L724 PolarHBondContact O-N 3.19Å; A720-K743 HydrophobicContact CB-CB 3.9Å; A720-K743 HydrophobicContact CB-CG 4.45Å; A720-L747 HydrophobicContact CB-CG 4.37Å
721	C	82.8	Confident	77.2	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-56	-54.3	173.9	-68.9	0	0	0	0	111.4	A717 K718 S723 L724 I725 Y775	A717-C721 PolarHBondContact O-N 2.86Å; A717-C721 PolarHBondContact O-SG 3.4Å; A717-C721 VanDerWaalsContact O-SG 3.41Å; K718-C721 PolarHBondContact O-N 3.07Å; C721-S723 VanDerWaalsContact C-N 3.28Å; C721-S723 PolarHBondContact O-N 3.02Å; C721-L724 PolarHBondContact O-N 3.18Å; C721-I725 WeakPolarHBondContact O-CG1 3.45Å; C721-I725 PolarHBondContact O-N 3.41Å; C721-Y775 HydrophobicContact CB-CD1 4Å; C721-Y775 HydrophobicContact CB-CD2 3.89Å; C721-Y775 HydrophobicContact CB-CE1 4.01Å; C721-Y775 HydrophobicContact CB-CE2 3.94Å; C721-Y775 HydrophobicContact CB-CG 3.95Å
722	E	83.5	Confident	76.2	Confident	99 Å²	99	73.5 Å²	73.5	46%	0.463	38%	0.383	S	S	.	.	H	α-helix	trans	-55	-41.7	-179.6	-73.1	170.7	-177.9	0	0	112.5	K718 Y775	K718-E722 VanDerWaalsContact CE-OE1 3.27Å; K718-E722 WeakPolarHBondContact CE-OE1 3.34Å; K718-E722 WeakPolarHBondContact O-CG 3.38Å; K718-E722 PolarHBondContact O-N 3.1Å; E722-Y775 HydrophobicContact CG-CE1 4.42Å
723	S	81.2	Confident	75.2	Confident	39 Å²	39	70 Å²	70	27%	0.273	37%	0.368	S	S	.	.	H	α-helix	trans	-72.2	-30.3	177.1	-177.7	0	0	0	0	114	K719 A720 C721 K743	K719-S723 WeakPolarHBondContact O-CB 3.35Å; K719-S723 PolarHBondContact O-N 3.03Å; A720-S723 PolarHBondContact O-N 3.13Å; C721-S723 VanDerWaalsContact C-N 3.28Å; C721-S723 PolarHBondContact O-N 3.02Å; S723-K743 VanDerWaalsContact CB-CD 3.49Å; S723-K743 VanDerWaalsContact CB-NZ 3.32Å; S723-K743 WeakPolarHBondContact OG-CD 3.47Å; S723-K743 PolarHBondContact OG-NZ 3.34Å
724	L	81.8	Confident	74	Confident	3 Å²	3	76 Å²	76	2%	0.016	41%	0.406	C	S	.	.	H	α-helix	trans	-77.8	-28.4	179.9	-73.8	168.3	0	0	0	111.5	A720 C721 G726 Y727 Y728 M740 K743 L744 L747 L779	A720-L724 WeakPolarHBondContact O-CB 3.39Å; A720-L724 VanDerWaalsContact O-CG 3.26Å; A720-L724 WeakPolarHBondContact O-CG 3.46Å; A720-L724 PolarHBondContact O-N 3.19Å; C721-L724 PolarHBondContact O-N 3.18Å; L724-G726 VanDerWaalsContact C-N 3.3Å; L724-G726 PolarHBondContact O-N 2.68Å; L724-Y727 WeakPolarHBondContact O-CA 3.15Å; L724-Y727 VanDerWaalsContact O-CB 3.27Å; L724-Y727 WeakPolarHBondContact O-CB 3.39Å; L724-Y727 PolarHBondContact O-N 3.12Å; L724-Y728 HydrophobicContact CB-CD2 4.28Å; L724-Y728 HydrophobicContact CB-CE2 4.2Å; L724-Y728 HydrophobicContact CD2-CE2 4.46Å; L724-Y728 VanDerWaalsContact O-CD2 3.27Å; L724-Y728 WeakPolarHBondContact O-CD2 3.17Å; L724-Y728 PolarHBondContact O-N 3.36Å; L724-M740 HydrophobicContact CD2-CB 3.85Å; L724-M740 HydrophobicContact CD2-CG 4.09Å; L724-K743 HydrophobicContact CD1-CB 4.15Å; L724-K743 HydrophobicContact CD2-CB 4.4Å; L724-K743 HydrophobicContact CG-CB 4.15Å; L724-L744 HydrophobicContact CD1-CB 4.33Å; L724-L747 HydrophobicContact CD1-CD1 3.76Å; L724-L779 HydrophobicContact CB-CD1 4.43Å; L724-L779 HydrophobicContact CD1-CD1 3.76Å
725	I	77.5	Confident	72.5	Confident	37 Å²	37	76.6 Å²	76.6	19%	0.19	42%	0.42	C	S	.	.	H	α-helix	trans	-52.4	-50.4	174.9	-65.1	164.4	0	0	0	110.9	C721 Y727 Y728 Q729 Y775	C721-I725 WeakPolarHBondContact O-CG1 3.45Å; C721-I725 PolarHBondContact O-N 3.41Å; I725-Y727 PolarHBondContact O-N 2.81Å; I725-Y727 VanDerWaalsContact O-N 3.08Å; I725-Y728 PolarHBondContact O-N 2.95Å; I725-Q729 VanDerWaalsContact CG2-CD 3.46Å; I725-Q729 HydrophobicContact CG2-CG 4.09Å; I725-Q729 WeakPolarHBondContact O-CB 3.4Å; I725-Q729 WeakPolarHBondContact O-CG 3.43Å; I725-Q729 PolarHBondContact O-N 3.15Å; I725-Y775 HydrophobicContact CD1-CD1 3.45Å; I725-Y775 VanDerWaalsContact CD1-CD1 3.45Å; I725-Y775 HydrophobicContact CD1-CE1 3.93Å; I725-Y775 HydrophobicContact CG1-CD1 4.02Å
726	G	72.2	Confident	71.3	Confident	34 Å²	34	76.1 Å²	76.1	35%	0.351	41%	0.409	S	S	.	.	H	α-helix	trans	-62.1	-17.8	-179.6	0	0	0	0	0	113.6	L724 A730	L724-G726 VanDerWaalsContact C-N 3.3Å; L724-G726 PolarHBondContact O-N 2.68Å; G726-A730 WeakPolarHBondContact O-CB 3.25Å; G726-A730 PolarHBondContact O-N 3.14Å
727	Y	71.9	Confident	70.1	Confident	60 Å²	60	72.3 Å²	72.3	24%	0.235	40%	0.399	C	S	.	.	H	α-helix	trans	-84.2	-50.9	171.9	-178.2	-115	0	0	0	112.5	L724 I725 Q729 A730 M740	L724-Y727 WeakPolarHBondContact O-CA 3.15Å; L724-Y727 VanDerWaalsContact O-CB 3.27Å; L724-Y727 WeakPolarHBondContact O-CB 3.39Å; L724-Y727 PolarHBondContact O-N 3.12Å; I725-Y727 PolarHBondContact O-N 2.81Å; I725-Y727 VanDerWaalsContact O-N 3.08Å; Y727-Q729 PolarHBondContact O-N 3.48Å; Y727-A730 PolarHBondContact O-N 3.41Å; Y727-A730 VanDerWaalsContact O-N 3.1Å; Y727-M740 VanDerWaalsContact CB-CE 3.47Å; Y727-M740 WeakPolarHBondContact CB-SD 3.5Å; Y727-M740 HydrophobicContact CD1-SD 3.91Å; Y727-M740 HydrophobicContact CD2-CE 3.71Å; Y727-M740 HydrophobicContact CD2-SD 3.1Å; Y727-M740 WeakPolarHBondContact CD2-SD 3.4Å; Y727-M740 HydrophobicContact CE1-SD 4.45Å; Y727-M740 HydrophobicContact CE2-SD 3.74Å; Y727-M740 HydrophobicContact CG-CE 3.85Å; Y727-M740 HydrophobicContact CG-SD 3.17Å
728	Y	71.9	Confident	69.3	Low	51 Å²	51	80 Å²	80	20%	0.2	44%	0.435	C	S	.	.	H	α-helix	trans	-66.5	-21.3	-179.3	-74.2	-76.1	0	0	0	112.5	L724 I725 S778 L779 D782	L724-Y728 HydrophobicContact CB-CD2 4.28Å; L724-Y728 HydrophobicContact CB-CE2 4.2Å; L724-Y728 HydrophobicContact CD2-CE2 4.46Å; L724-Y728 VanDerWaalsContact O-CD2 3.27Å; L724-Y728 WeakPolarHBondContact O-CD2 3.17Å; L724-Y728 PolarHBondContact O-N 3.36Å; I725-Y728 PolarHBondContact O-N 2.95Å; Y728-S778 VanDerWaalsContact CD1-CB 3.48Å; Y728-L779 HydrophobicContact CD2-CB 4.11Å; Y728-L779 HydrophobicContact CE2-CB 3.9Å; Y728-L779 HydrophobicContact CE2-CD1 3.72Å; Y728-L779 HydrophobicContact CE2-CG 4.39Å; Y728-D782 WeakPolarHBondContact CE1-OD2 3.24Å; Y728-D782 VanDerWaalsContact CZ-OD2 3.3Å; Y728-D782 WeakPolarHBondContact OH-CB 3.39Å; Y728-D782 PolarHBondContact OH-OD2 2.79Å
729	Q	68.8	Low	68.6	Low	159 Å²	159	81.9 Å²	81.9	74%	0.743	45%	0.446	S	S	*	.	S	Bend	trans	-89.5	-22.4	172.5	-67.6	-178.2	-7.7	0	0	114	I725 Y727	I725-Q729 VanDerWaalsContact CG2-CD 3.46Å; I725-Q729 HydrophobicContact CG2-CG 4.09Å; I725-Q729 WeakPolarHBondContact O-CB 3.4Å; I725-Q729 WeakPolarHBondContact O-CG 3.43Å; I725-Q729 PolarHBondContact O-N 3.15Å; Y727-Q729 PolarHBondContact O-N 3.48Å
730	A	62.2	Low	68	Low	48 Å²	48	75.7 Å²	75.7	40%	0.397	42%	0.419	S	S	.	.	S	Bend	trans	-98.9	159.5	-176.4	0	0	0	0	0	112.7	G726 Y727	G726-A730 WeakPolarHBondContact O-CB 3.25Å; G726-A730 PolarHBondContact O-N 3.14Å; Y727-A730 PolarHBondContact O-N 3.41Å; Y727-A730 VanDerWaalsContact O-N 3.1Å
731	E	52.8	Low	67.8	Low	169 Å²	169	80.9 Å²	80.9	79%	0.79	44%	0.441	S	S	*	.			trans	-63.2	143.8	171.9	-71.5	-174.3	167.2	0	0	111.4	T733	E731-T733 PolarHBondContact O-N 3.03Å
732	P	52.8	Low	67.9	Low	109 Å²	109	86 Å²	86	71%	0.708	47%	0.468	S	S	*	.			trans	-65.8	98.6	-174.4	25.3	-33.6	0	0	0	111.6
733	T	52.6	Low	68	Low	75 Å²	75	84.6 Å²	84.6	46%	0.46	46%	0.46	S	S	.	.			trans	-87.8	125.2	169.6	57.3	0	0	0	0	110.4	E731 G735 R736	E731-T733 PolarHBondContact O-N 3.03Å; T733-G735 PolarHBondContact O-N 3Å; T733-G735 VanDerWaalsContact O-N 3.09Å; T733-R736 PolarHBondContact O-N 3.35Å; T733-R736 WeakPolarHBondContact OG1-CD 3.21Å
734	V	52.3	Low	68.2	Low	147 Å²	147	84.8 Å²	84.8	89%	0.891	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-55.8	-29.7	-171.1	-178.1	0	0	0	0	114.4
735	G	53.4	Low	68.5	Low	69 Å²	69	88.4 Å²	88.4	71%	0.711	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-81.5	-16.5	-176.5	0	0	0	0	0	115.9	T733	T733-G735 PolarHBondContact O-N 3Å; T733-G735 VanDerWaalsContact O-N 3.09Å
736	R	57.2	Low	69	Low	122 Å²	122	88 Å²	88	46%	0.46	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-84.8	-14.3	-176.1	-86.2	-177.9	177.9	-177.7	0.3	113.9	T733 E738 M740	T733-R736 PolarHBondContact O-N 3.35Å; T733-R736 WeakPolarHBondContact OG1-CD 3.21Å; R736-E738 PolarHBondContact O-N 2.88Å; R736-M740 HydrophobicContact CB-CE 3.6Å; R736-M740 HydrophobicContact CB-SD 3.83Å; R736-M740 HydrophobicContact CG-CE 3.91Å; R736-M740 WeakPolarHBondContact O-CB 2.93Å; R736-M740 WeakPolarHBondContact O-CG 3.45Å; R736-M740 PolarHBondContact O-N 3.22Å
737	A	60.1	Low	69.8	Low	48 Å²	48	86.4 Å²	86.4	40%	0.397	46%	0.46	S	S	.	.	H	α-helix	trans	-66.3	-36.1	-170.4	0	0	0	0	0	114	K741	A737-K741 PolarHBondContact O-N 2.92Å; A737-K741 VanDerWaalsContact O-N 3.11Å
738	E	68.4	Low	70.6	Confident	163 Å²	163	84.4 Å²	84.4	76%	0.762	45%	0.454	S	S	*	.	H	α-helix	trans	-71.2	-50.4	-178.3	-69.9	-174.4	173.4	0	0	112	R736 M740 K741	R736-E738 PolarHBondContact O-N 2.88Å; E738-M740 PolarHBondContact O-N 3.44Å; E738-M740 VanDerWaalsContact O-N 3.15Å; E738-K741 VanDerWaalsContact O-CB 3.28Å; E738-K741 WeakPolarHBondContact O-CB 3.47Å; E738-K741 PolarHBondContact O-N 3.31Å
739	E	68.2	Low	71.4	Confident	136 Å²	136	87.6 Å²	87.6	64%	0.636	47%	0.469	S	S	*	.	H	α-helix	trans	-60.3	-27	176.9	-65.4	-178.2	177.3	0	0	112.8
740	M	71.9	Confident	72.3	Confident	17 Å²	17	81.2 Å²	81.2	8%	0.084	44%	0.439	C	S	.	.	H	α-helix	trans	-82.2	-26.3	178.3	-71.7	170	178.7	0	0	112.8	L724 Y727 R736 E738 D742 K743 L744	L724-M740 HydrophobicContact CD2-CB 3.85Å; L724-M740 HydrophobicContact CD2-CG 4.09Å; Y727-M740 VanDerWaalsContact CB-CE 3.47Å; Y727-M740 WeakPolarHBondContact CB-SD 3.5Å; Y727-M740 HydrophobicContact CD1-SD 3.91Å; Y727-M740 HydrophobicContact CD2-CE 3.71Å; Y727-M740 HydrophobicContact CD2-SD 3.1Å; Y727-M740 WeakPolarHBondContact CD2-SD 3.4Å; Y727-M740 HydrophobicContact CE1-SD 4.45Å; Y727-M740 HydrophobicContact CE2-SD 3.74Å; Y727-M740 HydrophobicContact CG-CE 3.85Å; Y727-M740 HydrophobicContact CG-SD 3.17Å; R736-M740 HydrophobicContact CB-CE 3.6Å; R736-M740 HydrophobicContact CB-SD 3.83Å; R736-M740 HydrophobicContact CG-CE 3.91Å; R736-M740 WeakPolarHBondContact O-CB 2.93Å; R736-M740 WeakPolarHBondContact O-CG 3.45Å; R736-M740 PolarHBondContact O-N 3.22Å; E738-M740 PolarHBondContact O-N 3.44Å; E738-M740 VanDerWaalsContact O-N 3.15Å; M740-D742 VanDerWaalsContact C-N 3.29Å; M740-D742 PolarHBondContact O-N 2.86Å; M740-K743 PolarHBondContact O-N 3.5Å; M740-L744 WeakPolarHBondContact O-CB 3.36Å; M740-L744 PolarHBondContact O-N 2.92Å
741	K	80.4	Confident	73.6	Confident	114 Å²	114	79 Å²	79	50%	0.496	42%	0.421	S	S	.	.	H	α-helix	trans	-61	-41.6	176.6	-171	-177.7	176.2	-174.3	0	110.9	A737 E738 L744 L745	A737-K741 PolarHBondContact O-N 2.92Å; A737-K741 VanDerWaalsContact O-N 3.11Å; E738-K741 VanDerWaalsContact O-CB 3.28Å; E738-K741 WeakPolarHBondContact O-CB 3.47Å; E738-K741 PolarHBondContact O-N 3.31Å; K741-L744 PolarHBondContact O-N 2.93Å; K741-L745 VanDerWaalsContact O-CB 3.24Å; K741-L745 WeakPolarHBondContact O-CB 3.34Å; K741-L745 PolarHBondContact O-N 3.27Å
742	D	84.6	Confident	75.4	Confident	108 Å²	108	72.4 Å²	72.4	58%	0.578	39%	0.39	S	S	*	.	H	α-helix	trans	-65.1	-41.4	178	-68.7	-17.1	0	0	0	111.5	M740 L745 T746	M740-D742 VanDerWaalsContact C-N 3.29Å; M740-D742 PolarHBondContact O-N 2.86Å; D742-L745 WeakPolarHBondContact O-CB 3.49Å; D742-L745 PolarHBondContact O-N 3.47Å; D742-T746 PolarHBondContact O-N 3.49Å; D742-T746 PolarHBondContact O-OG1 2.9Å
743	K	84.9	Confident	76.9	Confident	68 Å²	68	73.5 Å²	73.5	30%	0.296	39%	0.385	S	S	.	.	H	α-helix	trans	-66.7	-42.2	177.7	-62.2	-175.8	-163.6	-176.8	0	112	A720 S723 L724 M740 L745 T746 L747	A720-K743 HydrophobicContact CB-CB 3.9Å; A720-K743 HydrophobicContact CB-CG 4.45Å; S723-K743 VanDerWaalsContact CB-CD 3.49Å; S723-K743 VanDerWaalsContact CB-NZ 3.32Å; S723-K743 WeakPolarHBondContact OG-CD 3.47Å; S723-K743 PolarHBondContact OG-NZ 3.34Å; L724-K743 HydrophobicContact CD1-CB 4.15Å; L724-K743 HydrophobicContact CD2-CB 4.4Å; L724-K743 HydrophobicContact CG-CB 4.15Å; M740-K743 PolarHBondContact O-N 3.5Å; K743-L745 VanDerWaalsContact C-N 3.33Å; K743-T746 PolarHBondContact O-N 3.31Å; K743-L747 PolarHBondContact O-N 2.83Å
744	L	86	Confident	78.4	Confident	43 Å²	43	71.4 Å²	71.4	23%	0.225	37%	0.371	C	S	.	.	H	α-helix	trans	-64	-41.5	173.9	-178.7	62.8	0	0	0	110.5	L724 M740 K741 T746 L747 V748 L779 V783	L724-L744 HydrophobicContact CD1-CB 4.33Å; M740-L744 WeakPolarHBondContact O-CB 3.36Å; M740-L744 PolarHBondContact O-N 2.92Å; K741-L744 PolarHBondContact O-N 2.93Å; L744-T746 VanDerWaalsContact C-N 3.31Å; L744-T746 PolarHBondContact O-N 3.21Å; L744-L747 WeakPolarHBondContact O-CB 3.22Å; L744-L747 PolarHBondContact O-N 2.8Å; L744-L747 VanDerWaalsContact O-N 3.09Å; L744-V748 HydrophobicContact CD1-CG2 4.42Å; L744-V748 HydrophobicContact CG-CG2 4.28Å; L744-V748 WeakPolarHBondContact O-CG2 3.5Å; L744-V748 PolarHBondContact O-N 3.38Å; L744-L779 HydrophobicContact CD1-CD1 3.89Å; L744-V783 HydrophobicContact CD1-CG2 3.82Å
745	L	88.7	Confident	79.9	Confident	80 Å²	80	64.5 Å²	64.5	42%	0.419	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-38.8	177.9	-179	63.1	0	0	0	112.2	K741 D742 K743 L747 V748 K749	K741-L745 VanDerWaalsContact O-CB 3.24Å; K741-L745 WeakPolarHBondContact O-CB 3.34Å; K741-L745 PolarHBondContact O-N 3.27Å; D742-L745 WeakPolarHBondContact O-CB 3.49Å; D742-L745 PolarHBondContact O-N 3.47Å; K743-L745 VanDerWaalsContact C-N 3.33Å; L745-L747 VanDerWaalsContact C-N 3.32Å; L745-L747 PolarHBondContact O-N 2.78Å; L745-V748 PolarHBondContact O-N 3.12Å; L745-K749 HydrophobicContact CD1-CG 4.49Å; L745-K749 WeakPolarHBondContact O-CG 3.27Å; L745-K749 PolarHBondContact O-N 2.99Å
746	T	87.7	Confident	81.1	Confident	29 Å²	29	62.1 Å²	62.1	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-42.9	173.6	-58.4	0	0	0	0	111.7	E716 D742 K743 L744 K749 I750	E716-T746 HydrophobicContact CG-CG2 4.19Å; D742-T746 PolarHBondContact O-N 3.49Å; D742-T746 PolarHBondContact O-OG1 2.9Å; K743-T746 PolarHBondContact O-N 3.31Å; L744-T746 VanDerWaalsContact C-N 3.31Å; L744-T746 PolarHBondContact O-N 3.21Å; T746-K749 PolarHBondContact O-N 3.32Å; T746-I750 WeakPolarHBondContact O-CG1 3.39Å; T746-I750 PolarHBondContact O-N 3.09Å
747	L	88.4	Confident	82.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68.6	-40.4	176.5	-63.3	175.4	0	0	0	112.4	A717 A720 L724 K743 L744 L745 K749 I750 W751 L772 L779 V783	A717-L747 HydrophobicContact CB-CD2 3.97Å; A720-L747 HydrophobicContact CB-CG 4.37Å; L724-L747 HydrophobicContact CD1-CD1 3.76Å; K743-L747 PolarHBondContact O-N 2.83Å; L744-L747 WeakPolarHBondContact O-CB 3.22Å; L744-L747 PolarHBondContact O-N 2.8Å; L744-L747 VanDerWaalsContact O-N 3.09Å; L745-L747 VanDerWaalsContact C-N 3.32Å; L745-L747 PolarHBondContact O-N 2.78Å; L747-K749 VanDerWaalsContact C-N 3.34Å; L747-K749 PolarHBondContact O-N 2.69Å; L747-I750 PolarHBondContact O-N 3.22Å; L747-W751 WeakPolarHBondContact O-CB 3.38Å; L747-W751 PolarHBondContact O-N 3.28Å; L747-L772 HydrophobicContact CD1-CD2 4.21Å; L747-L772 HydrophobicContact CD2-CD2 4.47Å; L747-L779 HydrophobicContact CD1-CD1 3.96Å; L747-L779 HydrophobicContact CD1-CD2 4.03Å; L747-L779 HydrophobicContact CD1-CG 4.4Å; L747-V783 HydrophobicContact CB-CG2 4.19Å
748	V	89	Confident	82.7	Confident	17 Å²	17	61.9 Å²	61.9	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-62.2	-41.5	176.6	170.2	0	0	0	0	111	L744 L745 I750 W751 F752 S786	L744-V748 HydrophobicContact CD1-CG2 4.42Å; L744-V748 HydrophobicContact CG-CG2 4.28Å; L744-V748 WeakPolarHBondContact O-CG2 3.5Å; L744-V748 PolarHBondContact O-N 3.38Å; L745-V748 PolarHBondContact O-N 3.12Å; V748-I750 PolarHBondContact O-N 3.11Å; V748-W751 WeakPolarHBondContact O-CB 3.43Å; V748-W751 PolarHBondContact O-N 3.34Å; V748-F752 HydrophobicContact CG1-CD2 3.71Å; V748-F752 HydrophobicContact CG1-CE2 3.78Å; V748-F752 WeakPolarHBondContact O-CD2 3.42Å; V748-F752 PolarHBondContact O-N 3.49Å; V748-S786 WeakPolarHBondContact CG1-OG 3.41Å; V748-S786 VanDerWaalsContact CG2-CB 3.45Å
749	K	89.2	Confident	83.1	Confident	119 Å²	119	62.8 Å²	62.8	52%	0.517	32%	0.319	S	S	.	.	H	α-helix	trans	-58.8	-48.3	175.8	-76	175.3	177.4	179.7	0	111.9	L745 T746 L747 W751 F752 E753	L745-K749 HydrophobicContact CD1-CG 4.49Å; L745-K749 WeakPolarHBondContact O-CG 3.27Å; L745-K749 PolarHBondContact O-N 2.99Å; T746-K749 PolarHBondContact O-N 3.32Å; L747-K749 VanDerWaalsContact C-N 3.34Å; L747-K749 PolarHBondContact O-N 2.69Å; K749-W751 VanDerWaalsContact C-N 3.3Å; K749-W751 PolarHBondContact O-N 3.24Å; K749-F752 PolarHBondContact O-N 3.43Å; K749-E753 WeakPolarHBondContact O-CB 3.37Å; K749-E753 WeakPolarHBondContact O-CG 3.3Å; K749-E753 PolarHBondContact O-N 3.45Å
750	I	88	Confident	83.6	Confident	24 Å²	24	59.5 Å²	59.5	12%	0.123	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-43	176.8	-65	166.9	0	0	0	110.6	F711 A717 T746 L747 V748 F752 E753 L754 F768	F711-I750 HydrophobicContact CZ-CG2 4.2Å; A717-I750 HydrophobicContact CB-CD1 3.47Å; A717-I750 VanDerWaalsContact CB-CD1 3.47Å; T746-I750 WeakPolarHBondContact O-CG1 3.39Å; T746-I750 PolarHBondContact O-N 3.09Å; L747-I750 PolarHBondContact O-N 3.22Å; V748-I750 PolarHBondContact O-N 3.11Å; I750-F752 PolarHBondContact O-N 3.48Å; I750-E753 PolarHBondContact O-N 2.92Å; I750-L754 HydrophobicContact CG2-CD1 3.88Å; I750-L754 HydrophobicContact CG2-CG 4.37Å; I750-L754 WeakPolarHBondContact O-CB 3.35Å; I750-L754 VanDerWaalsContact O-CG 3.3Å; I750-L754 WeakPolarHBondContact O-CG 3.18Å; I750-L754 PolarHBondContact O-N 3.11Å; I750-F768 HydrophobicContact CB-CE2 4.19Å; I750-F768 HydrophobicContact CB-CZ 4.43Å; I750-F768 HydrophobicContact CG2-CD2 4.01Å; I750-F768 HydrophobicContact CG2-CE2 3.58Å; I750-F768 HydrophobicContact CG2-CZ 4.17Å
751	W	90.2	Very high	84.2	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-58.7	-48.5	177.3	174.6	-121.6	0	0	0	112.5	L747 V748 K749 L754 A755 I765 F768 I769 V783 C794 I810	L747-W751 WeakPolarHBondContact O-CB 3.38Å; L747-W751 PolarHBondContact O-N 3.28Å; V748-W751 WeakPolarHBondContact O-CB 3.43Å; V748-W751 PolarHBondContact O-N 3.34Å; K749-W751 VanDerWaalsContact C-N 3.3Å; K749-W751 PolarHBondContact O-N 3.24Å; W751-L754 PolarHBondContact O-N 2.99Å; W751-A755 HydrophobicContact CD2-CB 4.46Å; W751-A755 HydrophobicContact CE3-CB 4.35Å; W751-A755 HydrophobicContact CH2-CB 4.05Å; W751-A755 HydrophobicContact CZ2-CB 4.15Å; W751-A755 HydrophobicContact CZ3-CB 4.18Å; W751-A755 WeakPolarHBondContact O-CB 3.23Å; W751-A755 PolarHBondContact O-N 2.57Å; W751-I765 HydrophobicContact CH2-CG2 4.01Å; W751-I765 HydrophobicContact CZ3-CG2 3.68Å; W751-F768 HydrophobicContact CB-CE1 3.85Å; W751-F768 HydrophobicContact CB-CZ 4.22Å; W751-F768 HydrophobicContact CD2-CE1 4.31Å; W751-F768 AromaticContact CE3-CD1 3.66Å; W751-F768 HydrophobicContact CE3-CD1 3.66Å; W751-F768 AromaticContact CE3-CE1 3.73Å; W751-F768 HydrophobicContact CE3-CE1 3.73Å; W751-F768 HydrophobicContact CG-CE1 4.4Å; W751-F768 HydrophobicContact CZ3-CD1 4.21Å; W751-I769 HydrophobicContact CH2-CD1 3.98Å; W751-I769 HydrophobicContact CH2-CG1 4.3Å; W751-I769 HydrophobicContact CZ3-CD1 4.05Å; W751-I769 HydrophobicContact CZ3-CG1 3.96Å; W751-V783 HydrophobicContact CB-CG1 3.79Å; W751-V783 HydrophobicContact CD2-CG1 4.45Å; W751-V783 HydrophobicContact CG-CG1 3.83Å; W751-C794 HydrophobicContact CZ2-CB 4.07Å; W751-I810 HydrophobicContact CH2-CD1 4.22Å; W751-I810 HydrophobicContact CH2-CG1 3.86Å; W751-I810 HydrophobicContact CZ2-CD1 3.87Å; W751-I810 HydrophobicContact CZ2-CG1 3.83Å
752	F	89.1	Confident	84.4	Confident	31 Å²	31	60 Å²	60	14%	0.136	31%	0.314	C	S	.	.	H	α-helix	trans	-67.4	-37.8	177.6	-86.8	-96.1	0	0	0	112.4	V748 K749 I750 L754 A756 S786 D788 S792 Y797	V748-F752 HydrophobicContact CG1-CD2 3.71Å; V748-F752 HydrophobicContact CG1-CE2 3.78Å; V748-F752 WeakPolarHBondContact O-CD2 3.42Å; V748-F752 PolarHBondContact O-N 3.49Å; K749-F752 PolarHBondContact O-N 3.43Å; I750-F752 PolarHBondContact O-N 3.48Å; F752-L754 VanDerWaalsContact C-N 3.3Å; F752-L754 PolarHBondContact O-N 3.01Å; F752-A756 HydrophobicContact CD1-CB 4.15Å; F752-A756 WeakPolarHBondContact O-CA 3.32Å; F752-A756 WeakPolarHBondContact O-CB 3.37Å; F752-A756 PolarHBondContact O-N 3.29Å; F752-S786 WeakPolarHBondContact CE2-OG 3.37Å; F752-D788 HydrophobicContact CE1-CB 3.93Å; F752-D788 HydrophobicContact CZ-CB 4.06Å; F752-S792 WeakPolarHBondContact CZ-O 3.31Å; F752-Y797 HydrophobicContact CD1-CD2 4.34Å; F752-Y797 HydrophobicContact CD1-CE2 4.34Å; F752-Y797 AromaticContact CE1-CD2 3.97Å; F752-Y797 HydrophobicContact CE1-CD2 3.97Å; F752-Y797 AromaticContact CE1-CE2 3.88Å; F752-Y797 HydrophobicContact CE1-CE2 3.88Å
753	E	85.6	Confident	84.3	Confident	132 Å²	132	57.2 Å²	57.2	62%	0.617	30%	0.298	S	S	*	.	H	α-helix	trans	-62.6	-36.3	175.1	-75.1	173.9	-175.3	0	0	112.4	K749 I750 T757	K749-E753 WeakPolarHBondContact O-CB 3.37Å; K749-E753 WeakPolarHBondContact O-CG 3.3Å; K749-E753 PolarHBondContact O-N 3.45Å; I750-E753 PolarHBondContact O-N 2.92Å; E753-T757 WeakPolarHBondContact O-CG2 3.35Å; E753-T757 PolarHBondContact O-OG1 2.87Å
754	L	83.4	Confident	84.3	Confident	32 Å²	32	54.9 Å²	54.9	17%	0.168	29%	0.29	C	S	.	.	H	α-helix	trans	-77.3	-43.7	179	-70.2	173.7	0	0	0	112.8	F711 I750 W751 F752 I765 F768	F711-L754 HydrophobicContact CE2-CD1 4.1Å; F711-L754 HydrophobicContact CE2-CD2 4.14Å; F711-L754 HydrophobicContact CZ-CD1 3.96Å; I750-L754 HydrophobicContact CG2-CD1 3.88Å; I750-L754 HydrophobicContact CG2-CG 4.37Å; I750-L754 WeakPolarHBondContact O-CB 3.35Å; I750-L754 VanDerWaalsContact O-CG 3.3Å; I750-L754 WeakPolarHBondContact O-CG 3.18Å; I750-L754 PolarHBondContact O-N 3.11Å; W751-L754 PolarHBondContact O-N 2.99Å; F752-L754 VanDerWaalsContact C-N 3.3Å; F752-L754 PolarHBondContact O-N 3.01Å; L754-I765 HydrophobicContact CB-CG1 4.04Å; L754-F768 HydrophobicContact CD1-CB 4.01Å; L754-F768 HydrophobicContact CD1-CD2 4.21Å; L754-F768 HydrophobicContact CD1-CG 4.03Å
755	A	82.8	Confident	84.4	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-106.2	-14.8	-166.3	0	0	0	0	0	114.8	W751 I765 C794 V806	W751-A755 HydrophobicContact CD2-CB 4.46Å; W751-A755 HydrophobicContact CE3-CB 4.35Å; W751-A755 HydrophobicContact CH2-CB 4.05Å; W751-A755 HydrophobicContact CZ2-CB 4.15Å; W751-A755 HydrophobicContact CZ3-CB 4.18Å; W751-A755 WeakPolarHBondContact O-CB 3.23Å; W751-A755 PolarHBondContact O-N 2.57Å; A755-I765 HydrophobicContact CB-CD1 4.2Å; A755-C794 WeakPolarHBondContact CB-SG 3.31Å; A755-V806 HydrophobicContact CB-CG1 4.15Å
756	A	80.1	Confident	84.2	Confident	20 Å²	20	50.3 Å²	50.3	17%	0.165	27%	0.266	C	S	.	.	S	Bend	trans	-101.4	7.7	176.5	0	0	0	0	0	113.8	F752 Y797 H801	F752-A756 HydrophobicContact CD1-CB 4.15Å; F752-A756 WeakPolarHBondContact O-CA 3.32Å; F752-A756 WeakPolarHBondContact O-CB 3.37Å; F752-A756 PolarHBondContact O-N 3.29Å; A756-Y797 HydrophobicContact CB-CD1 4.29Å; A756-Y797 HydrophobicContact CB-CD2 4.12Å; A756-Y797 HydrophobicContact CB-CG 3.78Å; A756-H801 PolarHBondContact O-NE2 2.97Å
757	T	78.7	Confident	84.1	Confident	58 Å²	58	49.2 Å²	49.2	36%	0.356	26%	0.259	S	S	.	.	S	Bend	trans	-93.4	159.2	-179.7	48.8	0	0	0	0	112.6	E753 Q759	E753-T757 WeakPolarHBondContact O-CG2 3.35Å; E753-T757 PolarHBondContact O-OG1 2.87Å; T757-Q759 PolarHBondContact OG1-O 3.31Å
758	S	71.6	Confident	84.1	Confident	107 Å²	107	49.2 Å²	49.2	75%	0.748	26%	0.259	S	S	*	.	S	Bend	trans	-73.3	-28.4	177.8	-175.4	0	0	0	0	112.9
759	Q	77.6	Confident	84	Confident	181 Å²	181	49 Å²	49	85%	0.846	26%	0.257	S	S	*	.	S	Bend	trans	-97.2	96.4	175.9	-70.7	-171.4	-3.7	0	0	109.3	T757	T757-Q759 PolarHBondContact OG1-O 3.31Å
760	I	78.8	Confident	83.8	Confident	68 Å²	68	43.5 Å²	43.5	35%	0.349	23%	0.234	S	C	.	.			trans	-88.4	119.2	-173.7	-63.3	148.7	0	0	0	109.4	I765 A803 V806	I760-I765 HydrophobicContact CG2-CD1 3.92Å; I760-A803 HydrophobicContact CD1-CB 3.36Å; I760-A803 HydrophobicContact CG1-CB 4.43Å; I760-V806 HydrophobicContact CD1-CG2 4.45Å; I760-V806 HydrophobicContact CG1-CG2 4.41Å; I760-V806 HydrophobicContact CG2-CG2 3.38Å
761	D	83	Confident	83.6	Confident	83 Å²	83	43.1 Å²	43.1	44%	0.444	23%	0.232	S	C	.	.			trans	-97.7	90.3	164.4	-176.4	8.6	0	0	0	109.7	L763 S764 I765	D761-L763 PolarHBondContact O-N 3.43Å; D761-L763 PolarHBondContact OD1-N 3.11Å; D761-S764 PolarHBondContact O-N 3.19Å; D761-S764 VanDerWaalsContact O-N 3.17Å; D761-S764 VanDerWaalsContact OD2-CB 3.28Å; D761-S764 WeakPolarHBondContact OD2-CB 3.06Å; D761-S764 PolarHBondContact OD2-OG 3.12Å; D761-I765 WeakPolarHBondContact O-CG1 3.08Å; D761-I765 PolarHBondContact O-N 3.26Å
762	L	85.3	Confident	83.4	Confident	59 Å²	59	43.1 Å²	43.1	31%	0.309	23%	0.232	S	C	.	.	H	α-helix	trans	-55.4	-37.5	-178	-179.3	63.4	0	0	0	112	I765 E766 Q805 L809	L762-I765 PolarHBondContact O-N 3.29Å; L762-E766 WeakPolarHBondContact O-CG 3.4Å; L762-E766 PolarHBondContact O-N 3.03Å; L762-Q805 HydrophobicContact CD1-CB 4.17Å; L762-Q805 HydrophobicContact CD2-CB 4.09Å; L762-L809 HydrophobicContact CD1-CD2 4.06Å
763	L	82.3	Confident	83.2	Confident	49 Å²	49	43.9 Å²	43.9	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-68.2	-39.8	-177.7	-174.2	58.8	0	0	0	111.4	D761 I765 E766 D767	D761-L763 PolarHBondContact O-N 3.43Å; D761-L763 PolarHBondContact OD1-N 3.11Å; L763-I765 VanDerWaalsContact C-N 3.33Å; L763-I765 PolarHBondContact O-N 3.42Å; L763-E766 PolarHBondContact O-N 3.24Å; L763-D767 WeakPolarHBondContact O-CB 3.14Å; L763-D767 PolarHBondContact O-N 3.39Å
764	S	85.8	Confident	83.1	Confident	18 Å²	18	42.1 Å²	42.1	13%	0.126	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-35.6	174.8	-72.7	0	0	0	0	112.7	D761 F768	D761-S764 PolarHBondContact O-N 3.19Å; D761-S764 VanDerWaalsContact O-N 3.17Å; D761-S764 VanDerWaalsContact OD2-CB 3.28Å; D761-S764 WeakPolarHBondContact OD2-CB 3.06Å; D761-S764 PolarHBondContact OD2-OG 3.12Å; S764-F768 VanDerWaalsContact O-CB 3.26Å; S764-F768 WeakPolarHBondContact O-CB 3.05Å; S764-F768 PolarHBondContact O-N 3.29Å
765	I	86.5	Confident	83.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-45.2	175.9	-60	170.1	0	0	0	110.6	W751 L754 A755 I760 D761 L762 L763 F768 I769 V806 L809	W751-I765 HydrophobicContact CH2-CG2 4.01Å; W751-I765 HydrophobicContact CZ3-CG2 3.68Å; L754-I765 HydrophobicContact CB-CG1 4.04Å; A755-I765 HydrophobicContact CB-CD1 4.2Å; I760-I765 HydrophobicContact CG2-CD1 3.92Å; D761-I765 WeakPolarHBondContact O-CG1 3.08Å; D761-I765 PolarHBondContact O-N 3.26Å; L762-I765 PolarHBondContact O-N 3.29Å; L763-I765 VanDerWaalsContact C-N 3.33Å; L763-I765 PolarHBondContact O-N 3.42Å; I765-F768 PolarHBondContact O-N 3.31Å; I765-I769 HydrophobicContact CG2-CD1 4Å; I765-I769 WeakPolarHBondContact O-CG1 3.25Å; I765-I769 PolarHBondContact O-N 3.03Å; I765-V806 HydrophobicContact CD1-CG1 4.17Å; I765-V806 HydrophobicContact CD1-CG2 3.76Å; I765-L809 HydrophobicContact CB-CD2 4.08Å; I765-L809 HydrophobicContact CG2-CD2 3.51Å
766	E	85.9	Confident	83.2	Confident	28 Å²	28	44.2 Å²	44.2	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-58.6	-48.5	176.1	-74.6	178.4	179.9	0	0	111.4	W703 R707 L762 L763 F768 I769 A770 L809	W703-E766 WeakPolarHBondContact CH2-OE1 3.28Å; R707-E766 IonicContact CZ-OE2 4Å; R707-E766 IonicContact NH1-OE2 2.83Å; R707-E766 PolarHBondContact NH1-OE2 2.62Å; R707-E766 IonicContact NH2-OE2 2.74Å; L762-E766 WeakPolarHBondContact O-CG 3.4Å; L762-E766 PolarHBondContact O-N 3.03Å; L763-E766 PolarHBondContact O-N 3.24Å; E766-F768 PolarHBondContact O-N 3.05Å; E766-I769 PolarHBondContact O-N 3.12Å; E766-A770 WeakPolarHBondContact O-CB 3.43Å; E766-A770 PolarHBondContact O-N 2.9Å; E766-L809 HydrophobicContact CB-CD2 4.38Å; E766-L809 HydrophobicContact CG-CD1 3.85Å; E766-L809 HydrophobicContact CG-CD2 3.56Å; E766-L809 HydrophobicContact CG-CG 4.37Å
767	D	85.8	Confident	83.3	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.027	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-42.4	177.5	-74.9	-9.4	0	0	0	111	Y709 R710 F711 L763 I769 A770 I771	Y709-D767 HydrophobicContact CD1-CB 4.34Å; R710-D767 PolarHBondContact N-OD2 3.41Å; F711-D767 HydrophobicContact CB-CB 3.52Å; F711-D767 PolarHBondContact N-OD2 3.27Å; L763-D767 WeakPolarHBondContact O-CB 3.14Å; L763-D767 PolarHBondContact O-N 3.39Å; D767-I769 PolarHBondContact O-N 3.44Å; D767-A770 PolarHBondContact O-N 3.08Å; D767-I771 WeakPolarHBondContact O-CB 3.3Å; D767-I771 WeakPolarHBondContact O-CD1 3.37Å; D767-I771 WeakPolarHBondContact O-CG1 3.43Å; D767-I771 PolarHBondContact O-N 3.2Å
768	F	87	Confident	83.5	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-44.1	177.6	-177.3	-98.6	0	0	0	112.4	F711 L713 I750 W751 L754 S764 I765 E766 I771 L772 V783	F711-F768 HydrophobicContact CD1-CB 4.43Å; F711-F768 HydrophobicContact CE1-CB 4.4Å; F711-F768 AromaticContact CE1-CD2 3.85Å; F711-F768 HydrophobicContact CE1-CD2 3.85Å; F711-F768 HydrophobicContact CZ-CD2 4.44Å; L713-F768 HydrophobicContact CD2-CD2 3.96Å; L713-F768 HydrophobicContact CD2-CE2 3.87Å; I750-F768 HydrophobicContact CB-CE2 4.19Å; I750-F768 HydrophobicContact CB-CZ 4.43Å; I750-F768 HydrophobicContact CG2-CD2 4.01Å; I750-F768 HydrophobicContact CG2-CE2 3.58Å; I750-F768 HydrophobicContact CG2-CZ 4.17Å; W751-F768 HydrophobicContact CB-CE1 3.85Å; W751-F768 HydrophobicContact CB-CZ 4.22Å; W751-F768 HydrophobicContact CD2-CE1 4.31Å; W751-F768 AromaticContact CE3-CD1 3.66Å; W751-F768 HydrophobicContact CE3-CD1 3.66Å; W751-F768 AromaticContact CE3-CE1 3.73Å; W751-F768 HydrophobicContact CE3-CE1 3.73Å; W751-F768 HydrophobicContact CG-CE1 4.4Å; W751-F768 HydrophobicContact CZ3-CD1 4.21Å; L754-F768 HydrophobicContact CD1-CB 4.01Å; L754-F768 HydrophobicContact CD1-CD2 4.21Å; L754-F768 HydrophobicContact CD1-CG 4.03Å; S764-F768 VanDerWaalsContact O-CB 3.26Å; S764-F768 WeakPolarHBondContact O-CB 3.05Å; S764-F768 PolarHBondContact O-N 3.29Å; I765-F768 PolarHBondContact O-N 3.31Å; E766-F768 PolarHBondContact O-N 3.05Å; F768-I771 PolarHBondContact O-N 2.99Å; F768-L772 HydrophobicContact CD1-CD1 3.89Å; F768-L772 HydrophobicContact CD1-CG 4.43Å; F768-L772 HydrophobicContact CE1-CD1 3.3Å; F768-L772 HydrophobicContact CE1-CG 4.12Å; F768-L772 HydrophobicContact CE2-CD1 4.45Å; F768-L772 HydrophobicContact CZ-CD1 3.64Å; F768-L772 HydrophobicContact CZ-CG 4.2Å; F768-L772 WeakPolarHBondContact O-CG 3.4Å; F768-L772 PolarHBondContact O-N 2.83Å; F768-V783 HydrophobicContact CE1-CG1 4.16Å
769	I	87.6	Confident	84.2	Confident	12 Å²	12	41 Å²	41	6%	0.062	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-44.9	175.9	-71.5	169.3	0	0	0	110.8	W751 I765 E766 D767 L772 H773 L780 L809 T813	W751-I769 HydrophobicContact CH2-CD1 3.98Å; W751-I769 HydrophobicContact CH2-CG1 4.3Å; W751-I769 HydrophobicContact CZ3-CD1 4.05Å; W751-I769 HydrophobicContact CZ3-CG1 3.96Å; I765-I769 HydrophobicContact CG2-CD1 4Å; I765-I769 WeakPolarHBondContact O-CG1 3.25Å; I765-I769 PolarHBondContact O-N 3.03Å; E766-I769 PolarHBondContact O-N 3.12Å; D767-I769 PolarHBondContact O-N 3.44Å; I769-L772 PolarHBondContact O-N 2.73Å; I769-H773 WeakPolarHBondContact O-CB 3.18Å; I769-H773 PolarHBondContact O-N 2.92Å; I769-L780 HydrophobicContact CB-CD1 4.46Å; I769-L780 HydrophobicContact CG1-CD1 4.46Å; I769-L780 HydrophobicContact CG2-CD1 4.09Å; I769-L780 HydrophobicContact CG2-CD2 4.29Å; I769-L809 HydrophobicContact CD1-CD1 4.34Å; I769-L809 HydrophobicContact CD1-CD2 3.77Å; I769-L809 HydrophobicContact CD1-CG 3.64Å; I769-T813 HydrophobicContact CD1-CG2 4.23Å; I769-T813 HydrophobicContact CG2-CG2 3.99Å
770	A	84.3	Confident	84.7	Confident	4 Å²	4	32.7 Å²	32.7	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-48.6	177.9	0	0	0	0	0	111.1	I704 Y709 E766 D767 L772 H773 D774	I704-A770 HydrophobicContact CG2-CB 3.39Å; Y709-A770 HydrophobicContact CD1-CB 4.47Å; Y709-A770 HydrophobicContact CE1-CB 3.86Å; E766-A770 WeakPolarHBondContact O-CB 3.43Å; E766-A770 PolarHBondContact O-N 2.9Å; D767-A770 PolarHBondContact O-N 3.08Å; A770-L772 PolarHBondContact O-N 2.92Å; A770-H773 WeakPolarHBondContact O-CB 3.41Å; A770-H773 PolarHBondContact O-N 3.06Å; A770-D774 VanDerWaalsContact O-CG 3.25Å; A770-D774 PolarHBondContact O-N 3.48Å
771	I	84.8	Confident	85.1	Confident	15 Å²	15	34.4 Å²	34.4	8%	0.077	18%	0.18	C	C	.	.	H	α-helix	trans	-61.2	-47.1	179.1	-63.7	161	0	0	0	111	Y709 F711 L713 D767 F768 H773 D774 Y775	Y709-I771 HydrophobicContact CD1-CD1 4.08Å; Y709-I771 HydrophobicContact CD1-CG1 3.56Å; Y709-I771 HydrophobicContact CD2-CG1 4.16Å; Y709-I771 HydrophobicContact CE1-CG1 3.64Å; Y709-I771 HydrophobicContact CE2-CG1 4.24Å; Y709-I771 HydrophobicContact CG-CD1 4.04Å; Y709-I771 HydrophobicContact CG-CG1 3.83Å; F711-I771 HydrophobicContact CD1-CD1 4.27Å; L713-I771 HydrophobicContact CD1-CB 4.19Å; L713-I771 HydrophobicContact CD1-CD1 3.98Å; L713-I771 HydrophobicContact CD1-CG2 3.33Å; L713-I771 HydrophobicContact CG-CD1 4.22Å; D767-I771 WeakPolarHBondContact O-CB 3.3Å; D767-I771 WeakPolarHBondContact O-CD1 3.37Å; D767-I771 WeakPolarHBondContact O-CG1 3.43Å; D767-I771 PolarHBondContact O-N 3.2Å; F768-I771 PolarHBondContact O-N 2.99Å; I771-H773 VanDerWaalsContact C-N 3.32Å; I771-H773 PolarHBondContact O-N 2.89Å; I771-D774 PolarHBondContact O-N 2.99Å; I771-Y775 HydrophobicContact CG2-CD2 3.57Å; I771-Y775 HydrophobicContact CG2-CE2 3.36Å; I771-Y775 WeakPolarHBondContact O-CD2 3.49Å; I771-Y775 PolarHBondContact O-N 3.33Å
772	L	85.9	Confident	85.3	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-62.9	-37.7	178.2	-73.8	-174.8	0	0	0	112.8	L747 F768 I769 A770 Y775 S776 L779 L780 V783	L747-L772 HydrophobicContact CD1-CD2 4.21Å; L747-L772 HydrophobicContact CD2-CD2 4.47Å; F768-L772 HydrophobicContact CD1-CD1 3.89Å; F768-L772 HydrophobicContact CD1-CG 4.43Å; F768-L772 HydrophobicContact CE1-CD1 3.3Å; F768-L772 HydrophobicContact CE1-CG 4.12Å; F768-L772 HydrophobicContact CE2-CD1 4.45Å; F768-L772 HydrophobicContact CZ-CD1 3.64Å; F768-L772 HydrophobicContact CZ-CG 4.2Å; F768-L772 WeakPolarHBondContact O-CG 3.4Å; F768-L772 PolarHBondContact O-N 2.83Å; I769-L772 PolarHBondContact O-N 2.73Å; A770-L772 PolarHBondContact O-N 2.92Å; L772-Y775 PolarHBondContact O-N 2.93Å; L772-S776 CarbonylContact O-C 3.49Å; L772-S776 PolarHBondContact O-N 3.33Å; L772-S776 VanDerWaalsContact O-O 3.12Å; L772-L779 HydrophobicContact CD2-CD2 3.94Å; L772-L779 HydrophobicContact CD2-CG 4.31Å; L772-L780 HydrophobicContact CB-CB 4.28Å; L772-L780 HydrophobicContact CB-CD1 3.85Å; L772-L780 HydrophobicContact CD1-CD1 4.19Å; L772-V783 HydrophobicContact CD1-CB 3.99Å; L772-V783 HydrophobicContact CD1-CG1 3.83Å; L772-V783 HydrophobicContact CD1-CG2 4.02Å
773	H	84.7	Confident	85.4	Confident	48 Å²	48	29.8 Å²	29.8	22%	0.222	16%	0.155	C	C	.	.	H	α-helix	trans	-61.2	-45.7	174.8	-178.5	-88.3	0	0	0	111.5	I704 I769 A770 I771 Y775 S776 L780	I704-H773 HydrophobicContact CD1-CB 3.72Å; I704-H773 VanDerWaalsContact CD1-ND1 3.31Å; I704-H773 WeakPolarHBondContact CD1-ND1 3.45Å; I769-H773 WeakPolarHBondContact O-CB 3.18Å; I769-H773 PolarHBondContact O-N 2.92Å; A770-H773 WeakPolarHBondContact O-CB 3.41Å; A770-H773 PolarHBondContact O-N 3.06Å; I771-H773 VanDerWaalsContact C-N 3.32Å; I771-H773 PolarHBondContact O-N 2.89Å; H773-Y775 VanDerWaalsContact C-N 3.28Å; H773-Y775 PolarHBondContact O-N 3.08Å; H773-S776 PolarHBondContact O-N 3.33Å; H773-L780 HydrophobicContact CB-CD2 4.04Å
774	D	84.1	Confident	85.8	Confident	95 Å²	95	27.8 Å²	27.8	51%	0.508	15%	0.145	S	C	.	.	H	α-helix	trans	-65.8	-31.6	-180	-66.1	-27.6	0	0	0	112.2	Y709 A770 I771	Y709-D774 PolarHBondContact OH-OD2 3.08Å; A770-D774 VanDerWaalsContact O-CG 3.25Å; A770-D774 PolarHBondContact O-N 3.48Å; I771-D774 PolarHBondContact O-N 2.99Å
775	Y	82.9	Confident	86	Confident	59 Å²	59	29.7 Å²	29.7	23%	0.231	15%	0.151	C	C	.	.	H	α-helix	trans	-70.9	-54.9	171.8	-83.6	-67.5	0	0	0	112.8	L713 C721 E722 I725 I771 L772 H773	L713-Y775 HydrophobicContact CD1-CE2 4.46Å; C721-Y775 HydrophobicContact CB-CD1 4Å; C721-Y775 HydrophobicContact CB-CD2 3.89Å; C721-Y775 HydrophobicContact CB-CE1 4.01Å; C721-Y775 HydrophobicContact CB-CE2 3.94Å; C721-Y775 HydrophobicContact CB-CG 3.95Å; E722-Y775 HydrophobicContact CG-CE1 4.42Å; I725-Y775 HydrophobicContact CD1-CD1 3.45Å; I725-Y775 VanDerWaalsContact CD1-CD1 3.45Å; I725-Y775 HydrophobicContact CD1-CE1 3.93Å; I725-Y775 HydrophobicContact CG1-CD1 4.02Å; I771-Y775 HydrophobicContact CG2-CD2 3.57Å; I771-Y775 HydrophobicContact CG2-CE2 3.36Å; I771-Y775 WeakPolarHBondContact O-CD2 3.49Å; I771-Y775 PolarHBondContact O-N 3.33Å; L772-Y775 PolarHBondContact O-N 2.93Å; H773-Y775 VanDerWaalsContact C-N 3.28Å; H773-Y775 PolarHBondContact O-N 3.08Å
776	S	84.3	Confident	86.2	Confident	17 Å²	17	30.3 Å²	30.3	12%	0.119	16%	0.156	C	C	.	.			trans	-168.4	123.7	176.1	173.3	0	0	0	0	110.8	L772 H773 S778 L779 L780	L772-S776 CarbonylContact O-C 3.49Å; L772-S776 PolarHBondContact O-N 3.33Å; L772-S776 VanDerWaalsContact O-O 3.12Å; H773-S776 PolarHBondContact O-N 3.33Å; S776-S778 PolarHBondContact O-N 3.02Å; S776-S778 VanDerWaalsContact O-N 3.14Å; S776-S778 PolarHBondContact OG-N 2.73Å; S776-L779 WeakPolarHBondContact O-CB 3.28Å; S776-L779 PolarHBondContact O-N 3.27Å; S776-L779 PolarHBondContact OG-N 3.24Å; S776-L780 PolarHBondContact O-N 3.42Å
777	P	82.3	Confident	86.5	Confident	67 Å²	67	32.7 Å²	32.7	44%	0.435	17%	0.169	S	C	.	.	H	α-helix	trans	-58.3	-28	172.4	-26	34.6	0	0	0	113.5	R781	P777-R781 PolarHBondContact O-N 3.4Å; P777-R781 VanDerWaalsContact O-N 3.07Å
778	S	83.3	Confident	86.6	Confident	51 Å²	51	34.2 Å²	34.2	36%	0.357	18%	0.177	S	C	.	.	H	α-helix	trans	-72	-37.1	176.2	-61.2	0	0	0	0	112	Y728 S776 R781 D782	Y728-S778 VanDerWaalsContact CD1-CB 3.48Å; S776-S778 PolarHBondContact O-N 3.02Å; S776-S778 VanDerWaalsContact O-N 3.14Å; S776-S778 PolarHBondContact OG-N 2.73Å; S778-R781 PolarHBondContact O-N 3.22Å; S778-D782 PolarHBondContact O-N 2.91Å; S778-D782 VanDerWaalsContact O-N 3.17Å
779	L	86.1	Confident	86.7	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-45.6	173.6	174.9	63.1	0	0	0	110.4	L724 Y728 L744 L747 L772 S776 R781 D782 V783	L724-L779 HydrophobicContact CB-CD1 4.43Å; L724-L779 HydrophobicContact CD1-CD1 3.76Å; Y728-L779 HydrophobicContact CD2-CB 4.11Å; Y728-L779 HydrophobicContact CE2-CB 3.9Å; Y728-L779 HydrophobicContact CE2-CD1 3.72Å; Y728-L779 HydrophobicContact CE2-CG 4.39Å; L744-L779 HydrophobicContact CD1-CD1 3.89Å; L747-L779 HydrophobicContact CD1-CD1 3.96Å; L747-L779 HydrophobicContact CD1-CD2 4.03Å; L747-L779 HydrophobicContact CD1-CG 4.4Å; L772-L779 HydrophobicContact CD2-CD2 3.94Å; L772-L779 HydrophobicContact CD2-CG 4.31Å; S776-L779 WeakPolarHBondContact O-CB 3.28Å; S776-L779 PolarHBondContact O-N 3.27Å; S776-L779 PolarHBondContact OG-N 3.24Å; L779-R781 VanDerWaalsContact C-N 3.31Å; L779-R781 PolarHBondContact O-N 3.25Å; L779-D782 PolarHBondContact O-N 3.38Å; L779-V783 HydrophobicContact CD1-CG2 4.1Å; L779-V783 HydrophobicContact CG-CG2 4.43Å; L779-V783 WeakPolarHBondContact O-CG2 3.49Å; L779-V783 PolarHBondContact O-N 3.03Å
780	L	87.7	Confident	86.8	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-54.9	-48	176	178	66.6	0	0	0	111.4	I769 L772 H773 S776 D782 V783 I784	I769-L780 HydrophobicContact CB-CD1 4.46Å; I769-L780 HydrophobicContact CG1-CD1 4.46Å; I769-L780 HydrophobicContact CG2-CD1 4.09Å; I769-L780 HydrophobicContact CG2-CD2 4.29Å; L772-L780 HydrophobicContact CB-CB 4.28Å; L772-L780 HydrophobicContact CB-CD1 3.85Å; L772-L780 HydrophobicContact CD1-CD1 4.19Å; H773-L780 HydrophobicContact CB-CD2 4.04Å; S776-L780 PolarHBondContact O-N 3.42Å; L780-D782 VanDerWaalsContact C-N 3.34Å; L780-D782 PolarHBondContact O-N 3.49Å; L780-V783 PolarHBondContact O-N 3.38Å; L780-I784 HydrophobicContact CD1-CD1 3.7Å; L780-I784 HydrophobicContact CD1-CG1 4.05Å; L780-I784 HydrophobicContact CD2-CD1 4.36Å; L780-I784 HydrophobicContact CG-CD1 3.74Å; L780-I784 HydrophobicContact CG-CG1 4.38Å; L780-I784 WeakPolarHBondContact O-CG1 3.37Å; L780-I784 PolarHBondContact O-N 3.38Å
781	R	87.1	Confident	87.2	Confident	105 Å²	105	48.2 Å²	48.2	40%	0.396	25%	0.246	S	C	.	.	H	α-helix	trans	-55.4	-49.6	177.2	-175.8	-167	70.1	-176.7	-0.6	111.6	P777 S778 L779 V783 I784 Q785 H815	P777-R781 PolarHBondContact O-N 3.4Å; P777-R781 VanDerWaalsContact O-N 3.07Å; S778-R781 PolarHBondContact O-N 3.22Å; L779-R781 VanDerWaalsContact C-N 3.31Å; L779-R781 PolarHBondContact O-N 3.25Å; R781-V783 VanDerWaalsContact C-N 3.33Å; R781-V783 PolarHBondContact O-N 2.74Å; R781-I784 PolarHBondContact O-N 3.45Å; R781-Q785 WeakPolarHBondContact O-CB 3.29Å; R781-Q785 VanDerWaalsContact O-CG 3.29Å; R781-Q785 WeakPolarHBondContact O-CG 2.94Å; R781-Q785 PolarHBondContact O-N 3.29Å; R781-H815 HydrophobicContact CB-CB 4.26Å; R781-H815 HydrophobicContact CG-CB 4.01Å
782	D	86.9	Confident	87.5	Confident	45 Å²	45	47.8 Å²	47.8	24%	0.241	24%	0.244	C	C	.	.	H	α-helix	trans	-68.5	-31.7	-176.4	-68.7	2.3	0	0	0	112	Y728 S778 L779 L780 S786	Y728-D782 WeakPolarHBondContact CE1-OD2 3.24Å; Y728-D782 VanDerWaalsContact CZ-OD2 3.3Å; Y728-D782 WeakPolarHBondContact OH-CB 3.39Å; Y728-D782 PolarHBondContact OH-OD2 2.79Å; S778-D782 PolarHBondContact O-N 2.91Å; S778-D782 VanDerWaalsContact O-N 3.17Å; L779-D782 PolarHBondContact O-N 3.38Å; L780-D782 VanDerWaalsContact C-N 3.34Å; L780-D782 PolarHBondContact O-N 3.49Å; D782-S786 PolarHBondContact O-N 2.99Å
783	V	89.1	Confident	87.8	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-70.9	-44.4	172.9	174.2	0	0	0	0	111.5	L744 L747 W751 F768 L772 L779 L780 R781 Q785 S786	L744-V783 HydrophobicContact CD1-CG2 3.82Å; L747-V783 HydrophobicContact CB-CG2 4.19Å; W751-V783 HydrophobicContact CB-CG1 3.79Å; W751-V783 HydrophobicContact CD2-CG1 4.45Å; W751-V783 HydrophobicContact CG-CG1 3.83Å; F768-V783 HydrophobicContact CE1-CG1 4.16Å; L772-V783 HydrophobicContact CD1-CB 3.99Å; L772-V783 HydrophobicContact CD1-CG1 3.83Å; L772-V783 HydrophobicContact CD1-CG2 4.02Å; L779-V783 HydrophobicContact CD1-CG2 4.1Å; L779-V783 HydrophobicContact CG-CG2 4.43Å; L779-V783 WeakPolarHBondContact O-CG2 3.49Å; L779-V783 PolarHBondContact O-N 3.03Å; L780-V783 PolarHBondContact O-N 3.38Å; R781-V783 VanDerWaalsContact C-N 3.33Å; R781-V783 PolarHBondContact O-N 2.74Å; V783-Q785 VanDerWaalsContact C-N 3.33Å; V783-Q785 PolarHBondContact O-N 3.02Å; V783-S786 WeakPolarHBondContact O-CB 2.89Å; V783-S786 PolarHBondContact O-N 2.88Å; V783-S786 PolarHBondContact O-OG 3.4Å
784	I	89.6	Confident	88.1	Confident	7 Å²	7	45.8 Å²	45.8	4%	0.036	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-39.3	179.4	-69.7	176.1	0	0	0	111.7	L780 R781 S786 I810 T813 H815	L780-I784 HydrophobicContact CD1-CD1 3.7Å; L780-I784 HydrophobicContact CD1-CG1 4.05Å; L780-I784 HydrophobicContact CD2-CD1 4.36Å; L780-I784 HydrophobicContact CG-CD1 3.74Å; L780-I784 HydrophobicContact CG-CG1 4.38Å; L780-I784 WeakPolarHBondContact O-CG1 3.37Å; L780-I784 PolarHBondContact O-N 3.38Å; R781-I784 PolarHBondContact O-N 3.45Å; I784-S786 PolarHBondContact O-N 3.33Å; I784-I810 HydrophobicContact CG2-CG2 4.21Å; I784-T813 VanDerWaalsContact CD1-CB 3.46Å; I784-T813 HydrophobicContact CD1-CG2 3.43Å; I784-T813 VanDerWaalsContact CD1-CG2 3.43Å; I784-T813 WeakPolarHBondContact CD1-OG1 2.9Å; I784-H815 HydrophobicContact CD1-CB 4.39Å; I784-H815 HydrophobicContact CG2-CB 4.48Å
785	Q	90.3	Very high	88.5	Confident	57 Å²	57	41.6 Å²	41.6	27%	0.266	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	2.1	179.2	-64.5	-180	-0	0	0	113.4	R781 V783 H815 H817	R781-Q785 WeakPolarHBondContact O-CB 3.29Å; R781-Q785 VanDerWaalsContact O-CG 3.29Å; R781-Q785 WeakPolarHBondContact O-CG 2.94Å; R781-Q785 PolarHBondContact O-N 3.29Å; V783-Q785 VanDerWaalsContact C-N 3.33Å; V783-Q785 PolarHBondContact O-N 3.02Å; Q785-H815 WeakPolarHBondContact CG-O 3.4Å; Q785-H815 PolarHBondContact NE2-O 3.45Å; Q785-H817 VanDerWaalsContact CD-NE2 3.34Å; Q785-H817 PolarHBondContact NE2-CE1 2.82Å; Q785-H817 PolarHBondContact NE2-NE2 2.94Å
786	S	90.8	Very high	89	Confident	13 Å²	13	39 Å²	39	9%	0.091	20%	0.203	C	C	.	.			trans	-60.9	146	177.5	65	0	0	0	0	111.6	V748 F752 D782 V783 I784	V748-S786 WeakPolarHBondContact CG1-OG 3.41Å; V748-S786 VanDerWaalsContact CG2-CB 3.45Å; F752-S786 WeakPolarHBondContact CE2-OG 3.37Å; D782-S786 PolarHBondContact O-N 2.99Å; V783-S786 WeakPolarHBondContact O-CB 2.89Å; V783-S786 PolarHBondContact O-N 2.88Å; V783-S786 PolarHBondContact O-OG 3.4Å; I784-S786 PolarHBondContact O-N 3.33Å
787	I	91.3	Very high	89.3	Confident	78 Å²	78	41.3 Å²	41.3	40%	0.4	21%	0.21	S	C	.	.	B	Isolated β-bridge	trans	-118.2	145	-178.5	58.3	172.9	0	0	0	109.6	T793	I787-T793 HydrophobicContact CG2-CG2 3.88Å
788	D	89.4	Confident	89.7	Confident	38 Å²	38	38.1 Å²	38.1	20%	0.203	19%	0.189	C	C	.	.			trans	-84.7	-172.1	173.6	83.2	-27.3	0	0	0	112.1	F752 N790 N791 S792 Y797	F752-D788 HydrophobicContact CE1-CB 3.93Å; F752-D788 HydrophobicContact CZ-CB 4.06Å; D788-N790 VanDerWaalsContact CG-N 3.31Å; D788-N790 PolarHBondContact O-N 3.08Å; D788-N790 VanDerWaalsContact OD1-CA 3.26Å; D788-N790 WeakPolarHBondContact OD1-CA 3.35Å; D788-N790 WeakPolarHBondContact OD1-CB 3.38Å; D788-N790 PolarHBondContact OD1-N 3.33Å; D788-N790 WeakPolarHBondContact OD2-CB 3.41Å; D788-N790 PolarHBondContact OD2-N 3.45Å; D788-N790 PolarHBondContact OD2-ND2 2.79Å; D788-N791 PolarHBondContact O-N 3.21Å; D788-N791 PolarHBondContact OD1-N 3.08Å; D788-N791 VanDerWaalsContact OD1-N 3.08Å; D788-S792 PolarHBondContact N-O 2.93Å; D788-S792 WeakPolarHBondContact OD1-CA 3.32Å; D788-S792 WeakPolarHBondContact OD1-CB 3.24Å; D788-S792 PolarHBondContact OD1-N 3.4Å; D788-Y797 PolarHBondContact OD2-OH 3.39Å
789	E	88.1	Confident	90.1	Very high	171 Å²	171	35.7 Å²	35.7	80%	0.799	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.6	176.6	-58.2	-177.7	176.4	0	0	113.4	N791 R823	E789-N791 VanDerWaalsContact C-N 3.33Å; E789-R823 PolarHBondContact O-NH2 3.32Å
790	N	89.5	Confident	90.2	Very high	74 Å²	74	37.6 Å²	37.6	40%	0.396	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	10.3	175.6	-55.6	-57.7	0	0	0	112.7	D788 S792 R823	D788-N790 VanDerWaalsContact CG-N 3.31Å; D788-N790 PolarHBondContact O-N 3.08Å; D788-N790 VanDerWaalsContact OD1-CA 3.26Å; D788-N790 WeakPolarHBondContact OD1-CA 3.35Å; D788-N790 WeakPolarHBondContact OD1-CB 3.38Å; D788-N790 PolarHBondContact OD1-N 3.33Å; D788-N790 WeakPolarHBondContact OD2-CB 3.41Å; D788-N790 PolarHBondContact OD2-N 3.45Å; D788-N790 PolarHBondContact OD2-ND2 2.79Å; N790-S792 PolarHBondContact O-N 3.32Å; N790-S792 VanDerWaalsContact O-N 3.14Å; N790-R823 WeakPolarHBondContact O-CB 3.5Å; N790-R823 PolarHBondContact O-N 2.83Å
791	N	92.2	Very high	90.2	Very high	66 Å²	66	42.2 Å²	42.2	35%	0.353	21%	0.213	S	C	.	.	S	Bend	trans	54.4	23.7	-170.6	-61.1	-3.5	0	0	0	113.4	D788 E789 H820 N822	D788-N791 PolarHBondContact O-N 3.21Å; D788-N791 PolarHBondContact OD1-N 3.08Å; D788-N791 VanDerWaalsContact OD1-N 3.08Å; E789-N791 VanDerWaalsContact C-N 3.33Å; N791-H820 PolarHBondContact O-CD2 3.29Å; N791-H820 VanDerWaalsContact O-CD2 3.29Å; N791-H820 PolarHBondContact O-NE2 3.33Å; N791-N822 WeakPolarHBondContact O-CA 3.5Å
792	S	92.1	Very high	90.3	Very high	6 Å²	6	38.6 Å²	38.6	4%	0.042	21%	0.208	C	C	.	.			trans	-89.5	129.8	176.1	-60.8	0	0	0	0	108.9	F752 D788 N790 N822	F752-S792 WeakPolarHBondContact CZ-O 3.31Å; D788-S792 PolarHBondContact N-O 2.93Å; D788-S792 WeakPolarHBondContact OD1-CA 3.32Å; D788-S792 WeakPolarHBondContact OD1-CB 3.24Å; D788-S792 PolarHBondContact OD1-N 3.4Å; N790-S792 PolarHBondContact O-N 3.32Å; N790-S792 VanDerWaalsContact O-N 3.14Å; S792-N822 VanDerWaalsContact OG-CB 3.27Å; S792-N822 WeakPolarHBondContact OG-CB 3.45Å; S792-N822 PolarHBondContact OG-ND2 3.17Å
793	T	92.6	Very high	90.4	Very high	6 Å²	6	36.7 Å²	36.7	4%	0.037	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-78.8	161.4	166.6	63.5	0	0	0	0	109.8	I787 L795 H796 H820	I787-T793 HydrophobicContact CG2-CG2 3.88Å; T793-L795 PolarHBondContact O-N 3.41Å; T793-L795 VanDerWaalsContact O-N 3.13Å; T793-H796 PolarHBondContact N-ND1 3.11Å; T793-H796 VanDerWaalsContact N-ND1 3.13Å; T793-H796 VanDerWaalsContact O-CB 3.31Å; T793-H796 WeakPolarHBondContact O-CB 3.41Å; T793-H796 PolarHBondContact O-N 3.01Å; T793-H796 PolarHBondContact O-ND1 3.22Å; T793-H796 PolarHBondContact OG1-CE1 3.47Å; T793-H796 PolarHBondContact OG1-ND1 2.69Å; T793-H820 HydrophobicContact CG2-CB 4.28Å
794	C	90.1	Very high	90.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-54	-32.2	172.4	178.3	0	0	0	0	113.2	W751 A755 H796 Y797 S798	W751-C794 HydrophobicContact CZ2-CB 4.07Å; A755-C794 WeakPolarHBondContact CB-SG 3.31Å; C794-H796 PolarHBondContact O-N 3.43Å; C794-Y797 PolarHBondContact O-N 3.26Å; C794-Y797 VanDerWaalsContact O-N 3.13Å; C794-S798 PolarHBondContact O-N 2.84Å; C794-S798 PolarHBondContact O-OG 2.89Å; C794-S798 VanDerWaalsContact O-OG 3.13Å
795	L	93.5	Very high	90.4	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-31.9	175.6	-171.3	61.5	0	0	0	112.6	T793 S798 V799 V807 I810 A816 P818 P828 L849	T793-L795 PolarHBondContact O-N 3.41Å; T793-L795 VanDerWaalsContact O-N 3.13Å; L795-S798 WeakPolarHBondContact CA-OG 3.41Å; L795-S798 PolarHBondContact O-OG 3.27Å; L795-V799 HydrophobicContact CD1-CG2 4.18Å; L795-V799 HydrophobicContact CG-CG2 4.46Å; L795-V799 WeakPolarHBondContact O-CB 3.34Å; L795-V799 VanDerWaalsContact O-CG2 3.24Å; L795-V799 WeakPolarHBondContact O-CG2 3.46Å; L795-V799 PolarHBondContact O-N 2.71Å; L795-V807 HydrophobicContact CD1-CG1 4.03Å; L795-V807 HydrophobicContact CD1-CG2 4.41Å; L795-I810 HydrophobicContact CD1-CG2 4.14Å; L795-A816 HydrophobicContact CD2-CB 4.31Å; L795-P818 HydrophobicContact CD2-CB 4.42Å; L795-P828 HydrophobicContact CB-CG 4.19Å; L795-P828 HydrophobicContact CD2-CB 4.01Å; L795-P828 HydrophobicContact CD2-CG 3.98Å; L795-P828 HydrophobicContact CG-CB 3.83Å; L795-P828 HydrophobicContact CG-CG 3.96Å; L795-L849 HydrophobicContact CD2-CD1 4.14Å
796	H	93.7	Very high	90.4	Very high	5 Å²	5	40.5 Å²	40.5	2%	0.023	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-45.5	174.6	-67.8	74.6	0	0	0	111.5	T793 C794 G800 H820 F826 P828 I831	T793-H796 PolarHBondContact N-ND1 3.11Å; T793-H796 VanDerWaalsContact N-ND1 3.13Å; T793-H796 VanDerWaalsContact O-CB 3.31Å; T793-H796 WeakPolarHBondContact O-CB 3.41Å; T793-H796 PolarHBondContact O-N 3.01Å; T793-H796 PolarHBondContact O-ND1 3.22Å; T793-H796 PolarHBondContact OG1-CE1 3.47Å; T793-H796 PolarHBondContact OG1-ND1 2.69Å; C794-H796 PolarHBondContact O-N 3.43Å; H796-G800 PolarHBondContact O-N 2.85Å; H796-H820 AromaticContact CE1-CD2 3.85Å; H796-H820 PolarHBondContact CE1-O 3.46Å; H796-H820 PolarHBondContact NE2-O 3.02Å; H796-H820 VanDerWaalsContact NE2-O 3.1Å; H796-F826 PolarHBondContact NE2-O 3.48Å; H796-F826 VanDerWaalsContact NE2-O 3.09Å; H796-P828 VanDerWaalsContact CE1-CD 3.49Å; H796-P828 WeakPolarHBondContact CE1-CD 3.45Å; H796-P828 WeakPolarHBondContact NE2-CD 3.31Å; H796-I831 HydrophobicContact CB-CD1 3.77Å
797	Y	90.3	Very high	90.4	Very high	66 Å²	66	39.9 Å²	39.9	26%	0.259	21%	0.211	S	C	.	.	H	α-helix	trans	-69.7	-47	-178.5	-72.2	-79	0	0	0	112.1	F752 A756 D788 C794 V799 G800 H801	F752-Y797 HydrophobicContact CD1-CD2 4.34Å; F752-Y797 HydrophobicContact CD1-CE2 4.34Å; F752-Y797 AromaticContact CE1-CD2 3.97Å; F752-Y797 HydrophobicContact CE1-CD2 3.97Å; F752-Y797 AromaticContact CE1-CE2 3.88Å; F752-Y797 HydrophobicContact CE1-CE2 3.88Å; A756-Y797 HydrophobicContact CB-CD1 4.29Å; A756-Y797 HydrophobicContact CB-CD2 4.12Å; A756-Y797 HydrophobicContact CB-CG 3.78Å; D788-Y797 PolarHBondContact OD2-OH 3.39Å; C794-Y797 PolarHBondContact O-N 3.26Å; C794-Y797 VanDerWaalsContact O-N 3.13Å; Y797-V799 VanDerWaalsContact C-N 3.32Å; Y797-V799 PolarHBondContact O-N 3.32Å; Y797-G800 PolarHBondContact O-N 2.81Å; Y797-G800 VanDerWaalsContact O-N 3.16Å; Y797-H801 WeakPolarHBondContact O-CB 3.42Å; Y797-H801 PolarHBondContact O-CD2 3.46Å; Y797-H801 VanDerWaalsContact O-CD2 3.24Å; Y797-H801 PolarHBondContact O-N 3.41Å
798	S	90.1	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-41.7	178.4	54	0	0	0	0	112.2	C794 L795 G802 A803	C794-S798 PolarHBondContact O-N 2.84Å; C794-S798 PolarHBondContact O-OG 2.89Å; C794-S798 VanDerWaalsContact O-OG 3.13Å; L795-S798 WeakPolarHBondContact CA-OG 3.41Å; L795-S798 PolarHBondContact O-OG 3.27Å; S798-G802 PolarHBondContact O-N 3.48Å; S798-A803 WeakPolarHBondContact O-CB 3.34Å; S798-A803 PolarHBondContact O-N 2.89Å
799	V	91.7	Very high	90.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-46.3	173.2	174.4	0	0	0	0	111.4	L795 Y797 H801 G802 W804 V807 P828 I831 A832 L849	L795-V799 HydrophobicContact CD1-CG2 4.18Å; L795-V799 HydrophobicContact CG-CG2 4.46Å; L795-V799 WeakPolarHBondContact O-CB 3.34Å; L795-V799 VanDerWaalsContact O-CG2 3.24Å; L795-V799 WeakPolarHBondContact O-CG2 3.46Å; L795-V799 PolarHBondContact O-N 2.71Å; Y797-V799 VanDerWaalsContact C-N 3.32Å; Y797-V799 PolarHBondContact O-N 3.32Å; V799-H801 VanDerWaalsContact C-N 3.27Å; V799-H801 PolarHBondContact O-N 3.34Å; V799-G802 PolarHBondContact O-N 2.96Å; V799-W804 HydrophobicContact CG1-CH2 4.23Å; V799-W804 HydrophobicContact CG1-CZ3 4.26Å; V799-V807 HydrophobicContact CG2-CG1 4.36Å; V799-V807 HydrophobicContact CG2-CG2 3.69Å; V799-P828 HydrophobicContact CG2-CB 4.39Å; V799-I831 HydrophobicContact CG1-CB 4.34Å; V799-I831 HydrophobicContact CG1-CG2 4.13Å; V799-A832 HydrophobicContact CG1-CB 3.56Å; V799-L849 HydrophobicContact CG2-CD2 4.1Å
800	G	89	Confident	90.5	Very high	41 Å²	41	28.8 Å²	28.8	42%	0.423	16%	0.158	S	C	.	.	H	α-helix	trans	-61.9	-31.3	-179.7	0	0	0	0	0	114.1	H796 Y797 G802	H796-G800 PolarHBondContact O-N 2.85Å; Y797-G800 PolarHBondContact O-N 2.81Å; Y797-G800 VanDerWaalsContact O-N 3.16Å; G800-G802 VanDerWaalsContact C-N 3.34Å
801	H	87.6	Confident	90.6	Very high	101 Å²	101	25.4 Å²	25.4	47%	0.468	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-4	174.1	-66.9	-41.9	0	0	0	113.8	A756 Y797 V799 A803	A756-H801 PolarHBondContact O-NE2 2.97Å; Y797-H801 WeakPolarHBondContact O-CB 3.42Å; Y797-H801 PolarHBondContact O-CD2 3.46Å; Y797-H801 VanDerWaalsContact O-CD2 3.24Å; Y797-H801 PolarHBondContact O-N 3.41Å; V799-H801 VanDerWaalsContact C-N 3.27Å; V799-H801 PolarHBondContact O-N 3.34Å; H801-A803 VanDerWaalsContact C-N 3.27Å; H801-A803 PolarHBondContact O-N 3.37Å
802	G	87.5	Confident	90.4	Very high	29 Å²	29	25.5 Å²	25.5	30%	0.299	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	26	-176.2	0	0	0	0	0	113.5	S798 V799 G800 W804	S798-G802 PolarHBondContact O-N 3.48Å; V799-G802 PolarHBondContact O-N 2.96Å; G800-G802 VanDerWaalsContact C-N 3.34Å; G802-W804 VanDerWaalsContact C-N 3.27Å; G802-W804 PolarHBondContact O-N 2.92Å; G802-W804 PolarHBondContact O-NE1 3.49Å
803	A	89.6	Confident	90.2	Very high	5 Å²	5	25.8 Å²	25.8	4%	0.041	14%	0.142	C	C	.	.			trans	-80.5	63.4	-178.2	0	0	0	0	0	111.9	I760 S798 H801 Q805 V806 V807	I760-A803 HydrophobicContact CD1-CB 3.36Å; I760-A803 HydrophobicContact CG1-CB 4.43Å; S798-A803 WeakPolarHBondContact O-CB 3.34Å; S798-A803 PolarHBondContact O-N 2.89Å; H801-A803 VanDerWaalsContact C-N 3.27Å; H801-A803 PolarHBondContact O-N 3.37Å; A803-Q805 VanDerWaalsContact C-N 3.27Å; A803-Q805 PolarHBondContact O-N 2.73Å; A803-V806 HydrophobicContact CB-CB 4.07Å; A803-V806 HydrophobicContact CB-CG2 4.06Å; A803-V806 WeakPolarHBondContact O-CA 3.27Å; A803-V806 WeakPolarHBondContact O-CB 3.49Å; A803-V806 PolarHBondContact O-N 3.37Å; A803-V807 PolarHBondContact O-N 2.87Å
804	W	90.7	Very high	89.9	Confident	23 Å²	23	27.7 Å²	27.7	9%	0.087	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-30.9	-168.8	-53.9	113.6	0	0	0	114.6	V799 G802 V807 N808 I837 A842 T845 L846	V799-W804 HydrophobicContact CG1-CH2 4.23Å; V799-W804 HydrophobicContact CG1-CZ3 4.26Å; G802-W804 VanDerWaalsContact C-N 3.27Å; G802-W804 PolarHBondContact O-N 2.92Å; G802-W804 PolarHBondContact O-NE1 3.49Å; W804-V807 HydrophobicContact CE3-CG2 4.23Å; W804-V807 PolarHBondContact O-N 3.38Å; W804-N808 PolarHBondContact O-N 3.1Å; W804-N808 PolarHBondContact O-ND2 3.13Å; W804-I837 HydrophobicContact CH2-CD1 3.49Å; W804-I837 VanDerWaalsContact CH2-CD1 3.49Å; W804-I837 HydrophobicContact CZ2-CD1 3.2Å; W804-I837 HydrophobicContact CZ2-CG1 4.04Å; W804-A842 VanDerWaalsContact CD1-CB 3.43Å; W804-A842 HydrophobicContact CD2-CB 3.93Å; W804-A842 HydrophobicContact CG-CB 3.89Å; W804-A842 HydrophobicContact CZ2-CB 4.28Å; W804-T845 HydrophobicContact CB-CG2 4.21Å; W804-T845 HydrophobicContact CE3-CG2 3.97Å; W804-L846 HydrophobicContact CE3-CD2 4.37Å; W804-L846 HydrophobicContact CH2-CD2 3.71Å; W804-L846 HydrophobicContact CH2-CG 4.23Å; W804-L846 HydrophobicContact CZ3-CD2 3.44Å; W804-L846 VanDerWaalsContact CZ3-CD2 3.44Å; W804-L846 HydrophobicContact CZ3-CG 4.09Å
805	Q	89	Confident	89.6	Confident	120 Å²	120	29.7 Å²	29.7	56%	0.561	17%	0.172	S	C	*	.	H	α-helix	trans	-64.4	-41.4	173.7	-62.2	86.1	-14.7	0	0	111.3	L762 A803 N808 L809	L762-Q805 HydrophobicContact CD1-CB 4.17Å; L762-Q805 HydrophobicContact CD2-CB 4.09Å; A803-Q805 VanDerWaalsContact C-N 3.27Å; A803-Q805 PolarHBondContact O-N 2.73Å; Q805-N808 PolarHBondContact O-N 3.19Å; Q805-L809 PolarHBondContact O-N 3.49Å
806	V	89.7	Confident	89.4	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-67.8	-41	176	-178.1	0	0	0	0	110.5	A755 I760 I765 A803 N808 L809 I810	A755-V806 HydrophobicContact CB-CG1 4.15Å; I760-V806 HydrophobicContact CD1-CG2 4.45Å; I760-V806 HydrophobicContact CG1-CG2 4.41Å; I760-V806 HydrophobicContact CG2-CG2 3.38Å; I765-V806 HydrophobicContact CD1-CG1 4.17Å; I765-V806 HydrophobicContact CD1-CG2 3.76Å; A803-V806 HydrophobicContact CB-CB 4.07Å; A803-V806 HydrophobicContact CB-CG2 4.06Å; A803-V806 WeakPolarHBondContact O-CA 3.27Å; A803-V806 WeakPolarHBondContact O-CB 3.49Å; A803-V806 PolarHBondContact O-N 3.37Å; V806-N808 VanDerWaalsContact C-N 3.34Å; V806-N808 PolarHBondContact O-N 3.04Å; V806-L809 PolarHBondContact O-N 3.4Å; V806-I810 HydrophobicContact CG1-CD1 3.8Å; V806-I810 HydrophobicContact CG1-CG1 4.3Å; V806-I810 WeakPolarHBondContact O-CB 3.03Å; V806-I810 VanDerWaalsContact O-CG1 3.3Å; V806-I810 WeakPolarHBondContact O-CG1 3.21Å; V806-I810 PolarHBondContact O-N 2.92Å
807	V	91.6	Very high	89.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-48.2	174.6	175.2	0	0	0	0	110.3	L795 V799 A803 W804 L809 I810 L811 T845	L795-V807 HydrophobicContact CD1-CG1 4.03Å; L795-V807 HydrophobicContact CD1-CG2 4.41Å; V799-V807 HydrophobicContact CG2-CG1 4.36Å; V799-V807 HydrophobicContact CG2-CG2 3.69Å; A803-V807 PolarHBondContact O-N 2.87Å; W804-V807 HydrophobicContact CE3-CG2 4.23Å; W804-V807 PolarHBondContact O-N 3.38Å; V807-L809 PolarHBondContact O-N 3.32Å; V807-I810 PolarHBondContact O-N 3.16Å; V807-L811 HydrophobicContact CG1-CD1 3.88Å; V807-L811 HydrophobicContact CG1-CG 4.3Å; V807-L811 WeakPolarHBondContact O-CB 3.4Å; V807-L811 WeakPolarHBondContact O-CG 3.43Å; V807-L811 PolarHBondContact O-N 2.85Å; V807-T845 HydrophobicContact CB-CG2 4.01Å; V807-T845 HydrophobicContact CG1-CG2 3.71Å
808	N	91	Very high	89.2	Confident	40 Å²	40	31.5 Å²	31.5	21%	0.214	19%	0.185	C	C	.	.	H	α-helix	trans	-59.4	-46.7	177.2	-79.8	-53	0	0	0	112.1	W804 Q805 V806 I810 L811 D812 T845	W804-N808 PolarHBondContact O-N 3.1Å; W804-N808 PolarHBondContact O-ND2 3.13Å; Q805-N808 PolarHBondContact O-N 3.19Å; V806-N808 VanDerWaalsContact C-N 3.34Å; V806-N808 PolarHBondContact O-N 3.04Å; N808-I810 VanDerWaalsContact C-N 3.35Å; N808-I810 PolarHBondContact O-N 3.24Å; N808-L811 CarbonylContact O-C 3.5Å; N808-L811 PolarHBondContact O-N 3.3Å; N808-L811 VanDerWaalsContact O-N 3.13Å; N808-D812 WeakPolarHBondContact O-CB 3.42Å; N808-D812 PolarHBondContact O-N 3.27Å; N808-D812 VanDerWaalsContact O-OD2 3.11Å; N808-T845 WeakPolarHBondContact ND2-CG2 3.46Å; N808-T845 PolarHBondContact ND2-OG1 2.84Å
809	L	88.6	Confident	89.3	Confident	13 Å²	13	34.6 Å²	34.6	7%	0.068	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-42	179	-175.1	64.8	0	0	0	112.3	W703 L762 I765 E766 I769 Q805 V806 V807 D812 T813	W703-L809 HydrophobicContact CZ3-CD1 4.27Å; L762-L809 HydrophobicContact CD1-CD2 4.06Å; I765-L809 HydrophobicContact CB-CD2 4.08Å; I765-L809 HydrophobicContact CG2-CD2 3.51Å; E766-L809 HydrophobicContact CB-CD2 4.38Å; E766-L809 HydrophobicContact CG-CD1 3.85Å; E766-L809 HydrophobicContact CG-CD2 3.56Å; E766-L809 HydrophobicContact CG-CG 4.37Å; I769-L809 HydrophobicContact CD1-CD1 4.34Å; I769-L809 HydrophobicContact CD1-CD2 3.77Å; I769-L809 HydrophobicContact CD1-CG 3.64Å; Q805-L809 PolarHBondContact O-N 3.49Å; V806-L809 PolarHBondContact O-N 3.4Å; V807-L809 PolarHBondContact O-N 3.32Å; L809-D812 PolarHBondContact O-N 3Å; L809-T813 VanDerWaalsContact O-CG2 3.29Å; L809-T813 WeakPolarHBondContact O-CG2 3.36Å; L809-T813 PolarHBondContact O-N 2.92Å
810	I	90.8	Very high	89.4	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-42.9	174.5	-69.2	170.7	0	0	0	110.6	W751 I784 L795 V806 V807 N808 T813 A816	W751-I810 HydrophobicContact CH2-CD1 4.22Å; W751-I810 HydrophobicContact CH2-CG1 3.86Å; W751-I810 HydrophobicContact CZ2-CD1 3.87Å; W751-I810 HydrophobicContact CZ2-CG1 3.83Å; I784-I810 HydrophobicContact CG2-CG2 4.21Å; L795-I810 HydrophobicContact CD1-CG2 4.14Å; V806-I810 HydrophobicContact CG1-CD1 3.8Å; V806-I810 HydrophobicContact CG1-CG1 4.3Å; V806-I810 WeakPolarHBondContact O-CB 3.03Å; V806-I810 VanDerWaalsContact O-CG1 3.3Å; V806-I810 WeakPolarHBondContact O-CG1 3.21Å; V806-I810 PolarHBondContact O-N 2.92Å; V807-I810 PolarHBondContact O-N 3.16Å; N808-I810 VanDerWaalsContact C-N 3.35Å; N808-I810 PolarHBondContact O-N 3.24Å; I810-T813 PolarHBondContact O-N 2.8Å; I810-T813 PolarHBondContact O-OG1 2.84Å; I810-A816 HydrophobicContact CG2-CB 3.78Å
811	L	91.3	Very high	89.6	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-68.2	-33.8	177.5	-66	176.3	0	0	0	112.4	V807 N808 T813 G814 A816 R848 L849 M852	V807-L811 HydrophobicContact CG1-CD1 3.88Å; V807-L811 HydrophobicContact CG1-CG 4.3Å; V807-L811 WeakPolarHBondContact O-CB 3.4Å; V807-L811 WeakPolarHBondContact O-CG 3.43Å; V807-L811 PolarHBondContact O-N 2.85Å; N808-L811 CarbonylContact O-C 3.5Å; N808-L811 PolarHBondContact O-N 3.3Å; N808-L811 VanDerWaalsContact O-N 3.13Å; L811-T813 PolarHBondContact O-N 2.91Å; L811-G814 PolarHBondContact O-N 3.46Å; L811-A816 HydrophobicContact CD2-CB 3.96Å; L811-R848 HydrophobicContact CD1-CG 4.34Å; L811-L849 HydrophobicContact CD1-CB 4.28Å; L811-L849 HydrophobicContact CD1-CD1 4.24Å; L811-L849 HydrophobicContact CD2-CD1 4Å; L811-M852 HydrophobicContact CB-SD 4.13Å; L811-M852 HydrophobicContact CD1-SD 4.49Å; L811-M852 HydrophobicContact CD2-CE 3.83Å; L811-M852 HydrophobicContact CD2-SD 3.89Å; L811-M852 HydrophobicContact CG-SD 4.38Å
812	D	88.6	Confident	89.9	Confident	68 Å²	68	34.7 Å²	34.7	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-62.3	-26.8	177	-73.9	-33.4	0	0	0	112.5	N808 L809 G814 R848	N808-D812 WeakPolarHBondContact O-CB 3.42Å; N808-D812 PolarHBondContact O-N 3.27Å; N808-D812 VanDerWaalsContact O-OD2 3.11Å; L809-D812 PolarHBondContact O-N 3Å; D812-G814 PolarHBondContact O-N 3.34Å; D812-R848 IonicContact OD1-CZ 3.53Å; D812-R848 IonicContact OD1-NH1 3.22Å; D812-R848 PolarHBondContact OD1-NH1 2.98Å; D812-R848 IonicContact OD1-NH2 2.89Å; D812-R848 PolarHBondContact OD1-NH2 3.37Å; D812-R848 IonicContact OD2-NH1 3.93Å
813	T	86.6	Confident	90.1	Very high	11 Å²	11	41.8 Å²	41.8	7%	0.067	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.7	174.9	73.8	0	0	0	0	113.4	I769 I784 L809 I810 L811 H815	I769-T813 HydrophobicContact CD1-CG2 4.23Å; I769-T813 HydrophobicContact CG2-CG2 3.99Å; I784-T813 VanDerWaalsContact CD1-CB 3.46Å; I784-T813 HydrophobicContact CD1-CG2 3.43Å; I784-T813 VanDerWaalsContact CD1-CG2 3.43Å; I784-T813 WeakPolarHBondContact CD1-OG1 2.9Å; L809-T813 VanDerWaalsContact O-CG2 3.29Å; L809-T813 WeakPolarHBondContact O-CG2 3.36Å; L809-T813 PolarHBondContact O-N 2.92Å; I810-T813 PolarHBondContact O-N 2.8Å; I810-T813 PolarHBondContact O-OG1 2.84Å; L811-T813 PolarHBondContact O-N 2.91Å; T813-H815 PolarHBondContact O-CD2 3.43Å; T813-H815 PolarHBondContact O-N 2.94Å; T813-H815 VanDerWaalsContact O-N 3.16Å; T813-H815 PolarHBondContact OG1-N 3.03Å
814	G	85.9	Confident	90.2	Very high	47 Å²	47	45 Å²	45	49%	0.485	23%	0.233	S	C	.	.	S	Bend	trans	68.8	5.1	-177	0	0	0	0	0	115	L811 D812	L811-G814 PolarHBondContact O-N 3.46Å; D812-G814 PolarHBondContact O-N 3.34Å
815	H	85.4	Confident	90.3	Very high	42 Å²	42	43.9 Å²	43.9	19%	0.194	23%	0.229	C	C	.	.			trans	-106.4	-4.5	-178.4	-63	-39	0	0	0	113.9	R781 I784 Q785 T813	R781-H815 HydrophobicContact CB-CB 4.26Å; R781-H815 HydrophobicContact CG-CB 4.01Å; I784-H815 HydrophobicContact CD1-CB 4.39Å; I784-H815 HydrophobicContact CG2-CB 4.48Å; Q785-H815 WeakPolarHBondContact CG-O 3.4Å; Q785-H815 PolarHBondContact NE2-O 3.45Å; T813-H815 PolarHBondContact O-CD2 3.43Å; T813-H815 PolarHBondContact O-N 2.94Å; T813-H815 VanDerWaalsContact O-N 3.16Å; T813-H815 PolarHBondContact OG1-N 3.03Å
816	A	88.7	Confident	90.6	Very high	10 Å²	10	40.3 Å²	40.3	8%	0.083	21%	0.212	C	C	.	.			trans	-65.7	144.3	-178.7	0	0	0	0	0	112.9	L795 I810 L811 P818	L795-A816 HydrophobicContact CD2-CB 4.31Å; I810-A816 HydrophobicContact CG2-CB 3.78Å; L811-A816 HydrophobicContact CD2-CB 3.96Å; A816-P818 WeakPolarHBondContact O-CD 3.25Å
817	H	90.1	Very high	90.8	Very high	98 Å²	98	40.3 Å²	40.3	45%	0.454	21%	0.212	S	C	.	.			trans	-112.4	92.2	174.3	-75	-28	0	0	0	110.7	Q785 D819 H820	Q785-H817 VanDerWaalsContact CD-NE2 3.34Å; Q785-H817 PolarHBondContact NE2-CE1 2.82Å; Q785-H817 PolarHBondContact NE2-NE2 2.94Å; H817-D819 PolarHBondContact O-N 3.4Å; H817-H820 HydrophobicContact CB-CB 4.25Å; H817-H820 PolarHBondContact O-N 3.08Å
818	P	89.6	Confident	90.9	Very high	7 Å²	7	40.3 Å²	40.3	5%	0.045	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.2	-179.6	30.3	-36.5	0	0	0	113.9	L795 A816 P828 I829 L849 M852	L795-P818 HydrophobicContact CD2-CB 4.42Å; A816-P818 WeakPolarHBondContact O-CD 3.25Å; P818-P828 VanDerWaalsContact O-CD 3.31Å; P818-P828 WeakPolarHBondContact O-CD 3.49Å; P818-I829 HydrophobicContact CB-CD1 4.14Å; P818-I829 HydrophobicContact CB-CG1 4.28Å; P818-L849 HydrophobicContact CB-CD1 3.77Å; P818-M852 HydrophobicContact CG-CB 4.35Å; P818-M852 WeakPolarHBondContact CG-O 3.43Å
819	D	92.8	Very high	91.1	Very high	65 Å²	65	38.4 Å²	38.4	35%	0.348	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-6	-177.6	-64.5	-17.4	0	0	0	113.4	H817 I821 G853 D854 L857	H817-D819 PolarHBondContact O-N 3.4Å; D819-I821 PolarHBondContact O-N 2.74Å; D819-G853 VanDerWaalsContact OD1-CA 3.25Å; D819-G853 WeakPolarHBondContact OD1-CA 3.43Å; D819-D854 PolarHBondContact OD1-N 2.62Å; D819-L857 HydrophobicContact CB-CD1 3.53Å
820	H	93.7	Very high	91.4	Very high	61 Å²	61	37.8 Å²	37.8	28%	0.282	20%	0.198	S	C	.	.			trans	-63.8	131	-178.3	-172.1	78.3	0	0	0	110.2	N791 T793 H796 H817 S827 P828	N791-H820 PolarHBondContact O-CD2 3.29Å; N791-H820 VanDerWaalsContact O-CD2 3.29Å; N791-H820 PolarHBondContact O-NE2 3.33Å; T793-H820 HydrophobicContact CG2-CB 4.28Å; H796-H820 AromaticContact CE1-CD2 3.85Å; H796-H820 PolarHBondContact CE1-O 3.46Å; H796-H820 PolarHBondContact NE2-O 3.02Å; H796-H820 VanDerWaalsContact NE2-O 3.1Å; H817-H820 HydrophobicContact CB-CB 4.25Å; H817-H820 PolarHBondContact O-N 3.08Å; H820-S827 VanDerWaalsContact O-CA 3.28Å; H820-S827 WeakPolarHBondContact O-CA 3.34Å; H820-P828 VanDerWaalsContact O-CD 3.3Å; H820-P828 WeakPolarHBondContact O-CD 3.2Å
821	I	93	Very high	91.5	Very high	67 Å²	67	39 Å²	39	34%	0.344	20%	0.204	S	C	.	.			trans	-99.8	127.5	178.9	51	168.1	0	0	0	110.9	D819 F826 N860	D819-I821 PolarHBondContact O-N 2.74Å; I821-F826 WeakPolarHBondContact CA-O 3.48Å; I821-N860 HydrophobicContact CD1-CB 4.04Å
822	N	93.1	Very high	91.5	Very high	16 Å²	16	38.9 Å²	38.9	9%	0.086	20%	0.204	C	C	.	.			trans	-77.7	177.8	174.6	72.2	5.1	0	0	0	112.9	N791 S792 S824 G825 F826	N791-N822 WeakPolarHBondContact O-CA 3.5Å; S792-N822 VanDerWaalsContact OG-CB 3.27Å; S792-N822 WeakPolarHBondContact OG-CB 3.45Å; S792-N822 PolarHBondContact OG-ND2 3.17Å; N822-S824 PolarHBondContact O-N 2.56Å; N822-S824 WeakPolarHBondContact OD1-CA 3.48Å; N822-S824 WeakPolarHBondContact OD1-CB 3.39Å; N822-S824 PolarHBondContact OD1-N 3.5Å; N822-S824 VanDerWaalsContact OD1-N 3.14Å; N822-G825 WeakPolarHBondContact O-CA 3.48Å; N822-G825 PolarHBondContact O-N 2.81Å; N822-G825 PolarHBondContact OD1-N 3.11Å; N822-G825 VanDerWaalsContact OD1-N 3.08Å; N822-F826 PolarHBondContact N-O 3.22Å; N822-F826 PolarHBondContact OD1-N 2.9Å; N822-F826 PolarHBondContact OD1-O 2.97Å
823	R	92.8	Very high	91.6	Very high	178 Å²	178	35.7 Å²	35.7	67%	0.672	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.2	178.3	-175.6	-179.1	-74.4	-152.7	3.6	112.5	E789 N790 G825	E789-R823 PolarHBondContact O-NH2 3.32Å; N790-R823 WeakPolarHBondContact O-CB 3.5Å; N790-R823 PolarHBondContact O-N 2.83Å; R823-G825 PolarHBondContact O-N 3.37Å
824	S	91.3	Very high	91.7	Very high	72 Å²	72	37.9 Å²	37.9	50%	0.503	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-7.9	173.1	-54.8	0	0	0	0	112.9	N822 F826 T861	N822-S824 PolarHBondContact O-N 2.56Å; N822-S824 WeakPolarHBondContact OD1-CA 3.48Å; N822-S824 WeakPolarHBondContact OD1-CB 3.39Å; N822-S824 PolarHBondContact OD1-N 3.5Å; N822-S824 VanDerWaalsContact OD1-N 3.14Å; S824-F826 VanDerWaalsContact O-CD2 3.27Å; S824-F826 WeakPolarHBondContact O-CD2 3.3Å; S824-F826 WeakPolarHBondContact O-CE2 3.43Å; S824-T861 WeakPolarHBondContact O-CG2 3.23Å
825	G	92.4	Very high	91.5	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.01	19%	0.186	C	C	.	.	S	Bend	trans	84.9	19.7	177.4	0	0	0	0	0	114.4	N822 R823 T859 N860	N822-G825 WeakPolarHBondContact O-CA 3.48Å; N822-G825 PolarHBondContact O-N 2.81Å; N822-G825 PolarHBondContact OD1-N 3.11Å; N822-G825 VanDerWaalsContact OD1-N 3.08Å; R823-G825 PolarHBondContact O-N 3.37Å; G825-T859 CarbonylContact O-C 3.51Å; G825-T859 VanDerWaalsContact O-CA 3.27Å; G825-T859 WeakPolarHBondContact O-CA 3.34Å; G825-N860 PolarHBondContact O-N 3.02Å
826	F	95.1	Very high	91.3	Very high	45 Å²	45	41 Å²	41	20%	0.197	21%	0.208	C	C	.	.			trans	-111.5	141.7	-179.4	-66	-88.9	0	0	0	111.3	H796 I821 N822 S824 M830 I831 L834 T859 T861 L870	H796-F826 PolarHBondContact NE2-O 3.48Å; H796-F826 VanDerWaalsContact NE2-O 3.09Å; I821-F826 WeakPolarHBondContact CA-O 3.48Å; N822-F826 PolarHBondContact N-O 3.22Å; N822-F826 PolarHBondContact OD1-N 2.9Å; N822-F826 PolarHBondContact OD1-O 2.97Å; S824-F826 VanDerWaalsContact O-CD2 3.27Å; S824-F826 WeakPolarHBondContact O-CD2 3.3Å; S824-F826 WeakPolarHBondContact O-CE2 3.43Å; F826-M830 HydrophobicContact CB-CB 4.38Å; F826-M830 HydrophobicContact CB-SD 4.47Å; F826-M830 HydrophobicContact CD1-CB 3.94Å; F826-M830 HydrophobicContact CD1-SD 4.37Å; F826-I831 HydrophobicContact CB-CG1 4.03Å; F826-L834 HydrophobicContact CD1-CD1 4.3Å; F826-L834 HydrophobicContact CE1-CD1 4.13Å; F826-T859 HydrophobicContact CD1-CG2 3.96Å; F826-T859 HydrophobicContact CE1-CG2 3.78Å; F826-T859 HydrophobicContact CZ-CG2 4.46Å; F826-T861 HydrophobicContact CE2-CG2 4.44Å; F826-L870 HydrophobicContact CD1-CD1 4.25Å; F826-L870 HydrophobicContact CE1-CD1 4.03Å
827	S	94.6	Very high	91	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.			trans	-90.2	163.5	164.5	72.1	0	0	0	0	111.3	H820 I829 M830 I831	H820-S827 VanDerWaalsContact O-CA 3.28Å; H820-S827 WeakPolarHBondContact O-CA 3.34Å; S827-I829 PolarHBondContact O-N 2.94Å; S827-M830 PolarHBondContact N-SD 3.43Å; S827-M830 WeakPolarHBondContact O-CB 3.15Å; S827-M830 PolarHBondContact O-N 2.88Å; S827-M830 WeakPolarHBondContact OG-CG 3.16Å; S827-M830 PolarHBondContact OG-N 2.79Å; S827-I831 PolarHBondContact O-N 2.81Å
828	P	93.7	Very high	90.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-55.6	-37.8	173.4	-26.4	33.9	0	0	0	113	L795 H796 V799 P818 H820 M830 I831 A832	L795-P828 HydrophobicContact CB-CG 4.19Å; L795-P828 HydrophobicContact CD2-CB 4.01Å; L795-P828 HydrophobicContact CD2-CG 3.98Å; L795-P828 HydrophobicContact CG-CB 3.83Å; L795-P828 HydrophobicContact CG-CG 3.96Å; H796-P828 VanDerWaalsContact CE1-CD 3.49Å; H796-P828 WeakPolarHBondContact CE1-CD 3.45Å; H796-P828 WeakPolarHBondContact NE2-CD 3.31Å; V799-P828 HydrophobicContact CG2-CB 4.39Å; P818-P828 VanDerWaalsContact O-CD 3.31Å; P818-P828 WeakPolarHBondContact O-CD 3.49Å; H820-P828 VanDerWaalsContact O-CD 3.3Å; H820-P828 WeakPolarHBondContact O-CD 3.2Å; P828-M830 VanDerWaalsContact C-N 3.33Å; P828-M830 PolarHBondContact O-N 3.04Å; P828-I831 PolarHBondContact O-N 2.91Å; P828-A832 PolarHBondContact O-N 3.35Å
829	I	94.8	Very high	90.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-46	173.5	-70	176.3	0	0	0	110.5	P818 S827 A832 T833 L849 F850 P867	P818-I829 HydrophobicContact CB-CD1 4.14Å; P818-I829 HydrophobicContact CB-CG1 4.28Å; S827-I829 PolarHBondContact O-N 2.94Å; I829-A832 WeakPolarHBondContact O-CB 3.42Å; I829-A832 PolarHBondContact O-N 3.11Å; I829-T833 WeakPolarHBondContact O-CG2 3.35Å; I829-T833 PolarHBondContact O-N 3.11Å; I829-L849 HydrophobicContact CG1-CD2 4.34Å; I829-L849 HydrophobicContact CG1-CG 4.06Å; I829-F850 HydrophobicContact CB-CD1 4.46Å; I829-F850 HydrophobicContact CB-CE1 4.41Å; I829-F850 HydrophobicContact CG1-CD1 4.15Å; I829-F850 HydrophobicContact CG2-CD1 3.83Å; I829-F850 HydrophobicContact CG2-CE1 3.75Å; I829-P867 HydrophobicContact CG2-CB 4.28Å; I829-P867 HydrophobicContact CG2-CG 4.24Å
830	M	94.9	Very high	90.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.8	-40.6	178.1	-63.9	163.2	-173.8	0	0	112.1	F826 S827 P828 A832 T833 L834 L857 C858 T859 P867 L870	F826-M830 HydrophobicContact CB-CB 4.38Å; F826-M830 HydrophobicContact CB-SD 4.47Å; F826-M830 HydrophobicContact CD1-CB 3.94Å; F826-M830 HydrophobicContact CD1-SD 4.37Å; S827-M830 PolarHBondContact N-SD 3.43Å; S827-M830 WeakPolarHBondContact O-CB 3.15Å; S827-M830 PolarHBondContact O-N 2.88Å; S827-M830 WeakPolarHBondContact OG-CG 3.16Å; S827-M830 PolarHBondContact OG-N 2.79Å; P828-M830 VanDerWaalsContact C-N 3.33Å; P828-M830 PolarHBondContact O-N 3.04Å; M830-A832 VanDerWaalsContact C-N 3.28Å; M830-A832 PolarHBondContact O-N 2.85Å; M830-T833 PolarHBondContact O-N 3.5Å; M830-T833 PolarHBondContact O-OG1 3.02Å; M830-L834 PolarHBondContact O-N 3.29Å; M830-L857 HydrophobicContact CE-CB 3.8Å; M830-L857 WeakPolarHBondContact CE-O 3.42Å; M830-C858 WeakPolarHBondContact CE-O 3.33Å; M830-T859 HydrophobicContact CE-CG2 4.44Å; M830-T859 HydrophobicContact SD-CG2 3.72Å; M830-P867 HydrophobicContact CG-CG 4.03Å; M830-L870 HydrophobicContact CB-CD1 3.79Å; M830-L870 HydrophobicContact CG-CD1 4.1Å
831	I	92.4	Very high	90.3	Very high	28 Å²	28	45.6 Å²	45.6	14%	0.144	25%	0.25	C	C	.	.	H	α-helix	trans	-59.3	-43.4	176.8	-65.9	175.5	0	0	0	110.3	H796 V799 F826 S827 P828 T833 L834	H796-I831 HydrophobicContact CB-CD1 3.77Å; V799-I831 HydrophobicContact CG1-CB 4.34Å; V799-I831 HydrophobicContact CG1-CG2 4.13Å; F826-I831 HydrophobicContact CB-CG1 4.03Å; S827-I831 PolarHBondContact O-N 2.81Å; P828-I831 PolarHBondContact O-N 2.91Å; I831-T833 PolarHBondContact O-N 3.32Å; I831-L834 WeakPolarHBondContact O-CB 3.39Å; I831-L834 PolarHBondContact O-N 3.06Å; I831-L834 VanDerWaalsContact O-N 3.08Å
832	A	91.8	Very high	90.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.4	-35.7	174.6	0	0	0	0	0	112.9	V799 P828 I829 M830 L834 S835 L846 L849 F850	V799-A832 HydrophobicContact CG1-CB 3.56Å; P828-A832 PolarHBondContact O-N 3.35Å; I829-A832 WeakPolarHBondContact O-CB 3.42Å; I829-A832 PolarHBondContact O-N 3.11Å; M830-A832 VanDerWaalsContact C-N 3.28Å; M830-A832 PolarHBondContact O-N 2.85Å; A832-L834 VanDerWaalsContact C-N 3.29Å; A832-L834 PolarHBondContact O-N 3.36Å; A832-S835 PolarHBondContact O-N 2.85Å; A832-L846 HydrophobicContact CB-CD2 3.36Å; A832-L849 HydrophobicContact CB-CD2 4.43Å; A832-F850 HydrophobicContact CB-CE1 4.38Å
833	T	91.2	Very high	90.1	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-73.7	-17.7	179.6	64.6	0	0	0	0	114.7	I829 M830 I831 S835 F850 P867 L870 I879 L883	I829-T833 WeakPolarHBondContact O-CG2 3.35Å; I829-T833 PolarHBondContact O-N 3.11Å; M830-T833 PolarHBondContact O-N 3.5Å; M830-T833 PolarHBondContact O-OG1 3.02Å; I831-T833 PolarHBondContact O-N 3.32Å; T833-S835 VanDerWaalsContact C-N 3.32Å; T833-F850 HydrophobicContact CG2-CZ 4.36Å; T833-P867 HydrophobicContact CG2-CB 3.74Å; T833-L870 WeakPolarHBondContact OG1-CB 3.43Å; T833-I879 HydrophobicContact CG2-CG2 3.87Å; T833-L883 HydrophobicContact CG2-CD1 3.75Å; T833-L883 HydrophobicContact CG2-CD2 4.33Å; T833-L883 HydrophobicContact CG2-CG 4.48Å
834	L	88.6	Confident	90.1	Very high	58 Å²	58	41.8 Å²	41.8	30%	0.304	24%	0.236	S	C	.	.	H	α-helix	trans	-79	-19.8	176.1	-59.7	174.7	0	0	0	112.1	F826 M830 I831 A832 L870 H874	F826-L834 HydrophobicContact CD1-CD1 4.3Å; F826-L834 HydrophobicContact CE1-CD1 4.13Å; M830-L834 PolarHBondContact O-N 3.29Å; I831-L834 WeakPolarHBondContact O-CB 3.39Å; I831-L834 PolarHBondContact O-N 3.06Å; I831-L834 VanDerWaalsContact O-N 3.08Å; A832-L834 VanDerWaalsContact C-N 3.29Å; A832-L834 PolarHBondContact O-N 3.36Å; L834-L870 HydrophobicContact CD2-CB 4.1Å; L834-L870 HydrophobicContact CD2-CD1 4.27Å; L834-L870 HydrophobicContact CD2-CD2 4.08Å; L834-L870 HydrophobicContact CD2-CG 4.38Å; L834-H874 WeakPolarHBondContact CD2-CE1 3.33Å
835	S	81.6	Confident	90.1	Very high	35 Å²	35	38.7 Å²	38.7	25%	0.245	21%	0.214	C	C	.	.	S	Bend	trans	-83.9	133.3	178.9	-54.6	0	0	0	0	110.5	A832 T833 I837 I879	A832-S835 PolarHBondContact O-N 2.85Å; T833-S835 VanDerWaalsContact C-N 3.32Å; S835-I837 VanDerWaalsContact CB-CD1 3.46Å; S835-I837 PolarHBondContact O-N 3.36Å; S835-I837 VanDerWaalsContact O-N 3.12Å; S835-I879 WeakPolarHBondContact O-CD1 3.19Å
836	N	80.2	Confident	90.2	Very high	119 Å²	119	38.7 Å²	38.7	64%	0.636	21%	0.214	S	C	*	.			trans	-85.6	80.4	173.6	-173.3	18.7	0	0	0	110.5
837	I	84	Confident	90.1	Very high	21 Å²	21	38.5 Å²	38.5	11%	0.108	22%	0.218	C	C	.	.			trans	-98.9	123.2	-173.7	-61.4	153	0	0	0	110.3	W804 S835 A842 L846 I879	W804-I837 HydrophobicContact CH2-CD1 3.49Å; W804-I837 VanDerWaalsContact CH2-CD1 3.49Å; W804-I837 HydrophobicContact CZ2-CD1 3.2Å; W804-I837 HydrophobicContact CZ2-CG1 4.04Å; S835-I837 VanDerWaalsContact CB-CD1 3.46Å; S835-I837 PolarHBondContact O-N 3.36Å; S835-I837 VanDerWaalsContact O-N 3.12Å; I837-A842 HydrophobicContact CG2-CB 3.33Å; I837-L846 HydrophobicContact CD1-CD1 3.82Å; I837-I879 HydrophobicContact CB-CD1 4.49Å
838	T	82.8	Confident	90.1	Very high	101 Å²	101	42.2 Å²	42.2	62%	0.62	23%	0.232	S	C	*	.			trans	-114.2	-7	172.9	54.8	0	0	0	0	112.9	S840	T838-S840 PolarHBondContact O-N 3.4Å
839	D	89.2	Confident	90	Very high	85 Å²	85	42.2 Å²	42.2	46%	0.455	23%	0.232	S	C	.	.			trans	-68.2	130.6	-178.4	175.9	41.6	0	0	0	111.7	S841 A842 L843	D839-S841 VanDerWaalsContact C-N 3.31Å; D839-S841 PolarHBondContact O-N 2.89Å; D839-S841 WeakPolarHBondContact OD2-CB 3.15Å; D839-S841 PolarHBondContact OD2-N 3.46Å; D839-S841 PolarHBondContact OD2-OG 2.97Å; D839-A842 HydrophobicContact CB-CB 4.05Å; D839-A842 WeakPolarHBondContact O-CB 3.42Å; D839-A842 PolarHBondContact O-N 3.02Å; D839-A842 PolarHBondContact OD2-N 3.46Å; D839-L843 VanDerWaalsContact O-CG 3.3Å; D839-L843 WeakPolarHBondContact O-CG 3.34Å; D839-L843 PolarHBondContact O-N 2.87Å
840	S	89.4	Confident	90	Very high	72 Å²	72	42.4 Å²	42.4	50%	0.503	23%	0.233	S	C	.	.	H	α-helix	trans	-62.2	-37.2	-177.6	-173.8	0	0	0	0	112.4	T838 L843 K844	T838-S840 PolarHBondContact O-N 3.4Å; S840-L843 PolarHBondContact O-N 2.76Å; S840-K844 WeakPolarHBondContact O-CG 3.4Å; S840-K844 PolarHBondContact O-N 3.32Å; S840-K844 VanDerWaalsContact O-N 3.09Å
841	S	88.5	Confident	89.9	Confident	59 Å²	59	46.1 Å²	46.1	41%	0.413	26%	0.259	S	S	.	.	H	α-helix	trans	-68.8	-40.5	-179.8	86.5	0	0	0	0	111.7	D839 K844 T845	D839-S841 VanDerWaalsContact C-N 3.31Å; D839-S841 PolarHBondContact O-N 2.89Å; D839-S841 WeakPolarHBondContact OD2-CB 3.15Å; D839-S841 PolarHBondContact OD2-N 3.46Å; D839-S841 PolarHBondContact OD2-OG 2.97Å; S841-K844 PolarHBondContact O-N 3.34Å; S841-T845 PolarHBondContact O-N 2.75Å; S841-T845 PolarHBondContact O-OG1 3.03Å; S841-T845 VanDerWaalsContact O-OG1 3.05Å
842	A	90.4	Very high	89.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-46.4	174	0	0	0	0	0	111.8	W804 I837 D839 K844 T845 L846	W804-A842 VanDerWaalsContact CD1-CB 3.43Å; W804-A842 HydrophobicContact CD2-CB 3.93Å; W804-A842 HydrophobicContact CG-CB 3.89Å; W804-A842 HydrophobicContact CZ2-CB 4.28Å; I837-A842 HydrophobicContact CG2-CB 3.33Å; D839-A842 HydrophobicContact CB-CB 4.05Å; D839-A842 WeakPolarHBondContact O-CB 3.42Å; D839-A842 PolarHBondContact O-N 3.02Å; D839-A842 PolarHBondContact OD2-N 3.46Å; A842-K844 VanDerWaalsContact C-N 3.31Å; A842-K844 PolarHBondContact O-N 2.83Å; A842-T845 CarbonylContact O-C 3.57Å; A842-T845 WeakPolarHBondContact O-CA 3.28Å; A842-T845 WeakPolarHBondContact O-CB 3.25Å; A842-T845 PolarHBondContact O-N 2.95Å; A842-L846 WeakPolarHBondContact O-CG 3.2Å; A842-L846 PolarHBondContact O-N 3.46Å
843	L	92.5	Very high	89.6	Confident	30 Å²	30	49.4 Å²	49.4	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-37	178	-70.8	172.6	0	0	0	112.8	D839 S840 T845 L846 S847 D878 L882	D839-L843 VanDerWaalsContact O-CG 3.3Å; D839-L843 WeakPolarHBondContact O-CG 3.34Å; D839-L843 PolarHBondContact O-N 2.87Å; S840-L843 PolarHBondContact O-N 2.76Å; L843-T845 VanDerWaalsContact C-N 3.34Å; L843-L846 HydrophobicContact CD2-CD1 4.5Å; L843-L846 PolarHBondContact O-N 3.42Å; L843-S847 WeakPolarHBondContact O-CB 3.21Å; L843-S847 PolarHBondContact O-N 2.67Å; L843-D878 HydrophobicContact CD1-CB 4.03Å; L843-D878 HydrophobicContact CD2-CB 3.88Å; L843-L882 HydrophobicContact CB-CD1 4.06Å; L843-L882 HydrophobicContact CD2-CD1 3.48Å; L843-L882 VanDerWaalsContact CD2-CD1 3.48Å; L843-L882 HydrophobicContact CG-CD1 4.34Å
844	K	92.4	Very high	89.6	Confident	150 Å²	150	52.6 Å²	52.6	65%	0.652	30%	0.297	S	S	*	.	H	α-helix	trans	-62.2	-42.2	172.1	-73.3	173.9	-175.4	177.8	0	111.8	S840 S841 A842 S847 R848	S840-K844 WeakPolarHBondContact O-CG 3.4Å; S840-K844 PolarHBondContact O-N 3.32Å; S840-K844 VanDerWaalsContact O-N 3.09Å; S841-K844 PolarHBondContact O-N 3.34Å; A842-K844 VanDerWaalsContact C-N 3.31Å; A842-K844 PolarHBondContact O-N 2.83Å; K844-S847 WeakPolarHBondContact O-CB 3.32Å; K844-S847 PolarHBondContact O-N 3.47Å; K844-R848 PolarHBondContact O-N 3.37Å; K844-R848 VanDerWaalsContact O-N 3.08Å
845	T	92.3	Very high	89.7	Confident	8 Å²	8	50.1 Å²	50.1	5%	0.049	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-40.1	177.6	-53.7	0	0	0	0	111.3	W804 V807 N808 S841 A842 L843 R848 L849	W804-T845 HydrophobicContact CB-CG2 4.21Å; W804-T845 HydrophobicContact CE3-CG2 3.97Å; V807-T845 HydrophobicContact CB-CG2 4.01Å; V807-T845 HydrophobicContact CG1-CG2 3.71Å; N808-T845 WeakPolarHBondContact ND2-CG2 3.46Å; N808-T845 PolarHBondContact ND2-OG1 2.84Å; S841-T845 PolarHBondContact O-N 2.75Å; S841-T845 PolarHBondContact O-OG1 3.03Å; S841-T845 VanDerWaalsContact O-OG1 3.05Å; A842-T845 CarbonylContact O-C 3.57Å; A842-T845 WeakPolarHBondContact O-CA 3.28Å; A842-T845 WeakPolarHBondContact O-CB 3.25Å; A842-T845 PolarHBondContact O-N 2.95Å; L843-T845 VanDerWaalsContact C-N 3.34Å; T845-R848 WeakPolarHBondContact O-CB 3.14Å; T845-R848 PolarHBondContact O-N 2.98Å; T845-L849 PolarHBondContact O-N 2.88Å
846	L	94.1	Very high	90.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-43.2	174.3	-71.3	-174.9	0	0	0	112.5	W804 A832 I837 A842 L843 R848 L849 F850 I879 L882	W804-L846 HydrophobicContact CE3-CD2 4.37Å; W804-L846 HydrophobicContact CH2-CD2 3.71Å; W804-L846 HydrophobicContact CH2-CG 4.23Å; W804-L846 HydrophobicContact CZ3-CD2 3.44Å; W804-L846 VanDerWaalsContact CZ3-CD2 3.44Å; W804-L846 HydrophobicContact CZ3-CG 4.09Å; A832-L846 HydrophobicContact CB-CD2 3.36Å; I837-L846 HydrophobicContact CD1-CD1 3.82Å; A842-L846 WeakPolarHBondContact O-CG 3.2Å; A842-L846 PolarHBondContact O-N 3.46Å; L843-L846 HydrophobicContact CD2-CD1 4.5Å; L843-L846 PolarHBondContact O-N 3.42Å; L846-R848 VanDerWaalsContact C-N 3.26Å; L846-R848 PolarHBondContact O-N 2.89Å; L846-L849 HydrophobicContact CD2-CD2 4.33Å; L846-L849 PolarHBondContact O-N 3.37Å; L846-L849 VanDerWaalsContact O-N 3.14Å; L846-F850 HydrophobicContact CB-CE2 4.26Å; L846-F850 HydrophobicContact CB-CZ 4.27Å; L846-F850 HydrophobicContact CD2-CZ 4.47Å; L846-F850 WeakPolarHBondContact O-CB 3.38Å; L846-F850 WeakPolarHBondContact O-CD2 3.2Å; L846-F850 WeakPolarHBondContact O-CG 3.46Å; L846-F850 PolarHBondContact O-N 3.01Å; L846-I879 HydrophobicContact CD1-CG1 4.39Å; L846-L882 HydrophobicContact CB-CD1 4.33Å
847	S	93.4	Very high	90.8	Very high	41 Å²	41	47.9 Å²	47.9	29%	0.287	27%	0.269	S	S	.	.	H	α-helix	trans	-54.5	-46	172.6	-178.3	0	0	0	0	110.8	L843 K844 F850 S851 H886	L843-S847 WeakPolarHBondContact O-CB 3.21Å; L843-S847 PolarHBondContact O-N 2.67Å; K844-S847 WeakPolarHBondContact O-CB 3.32Å; K844-S847 PolarHBondContact O-N 3.47Å; S847-F850 PolarHBondContact O-N 3.4Å; S847-S851 WeakPolarHBondContact O-CB 3.48Å; S847-S851 PolarHBondContact O-N 3.26Å; S847-H886 PolarHBondContact O-NE2 3.13Å; S847-H886 PolarHBondContact OG-CE1 2.68Å; S847-H886 VanDerWaalsContact OG-CE1 3.27Å
848	R	93.1	Very high	91.3	Very high	79 Å²	79	48.9 Å²	48.9	30%	0.298	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-46.8	174.4	-172.1	-178.2	174	-176.9	1.9	112.5	L811 D812 K844 T845 L846 F850 S851 M852	L811-R848 HydrophobicContact CD1-CG 4.34Å; D812-R848 IonicContact OD1-CZ 3.53Å; D812-R848 IonicContact OD1-NH1 3.22Å; D812-R848 PolarHBondContact OD1-NH1 2.98Å; D812-R848 IonicContact OD1-NH2 2.89Å; D812-R848 PolarHBondContact OD1-NH2 3.37Å; D812-R848 IonicContact OD2-NH1 3.93Å; K844-R848 PolarHBondContact O-N 3.37Å; K844-R848 VanDerWaalsContact O-N 3.08Å; T845-R848 WeakPolarHBondContact O-CB 3.14Å; T845-R848 PolarHBondContact O-N 2.98Å; L846-R848 VanDerWaalsContact C-N 3.26Å; L846-R848 PolarHBondContact O-N 2.89Å; R848-F850 PolarHBondContact O-N 3.29Å; R848-S851 PolarHBondContact O-N 3.49Å; R848-S851 PolarHBondContact O-OG 3.47Å; R848-M852 PolarHBondContact O-N 3.49Å
849	L	93.6	Very high	91.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-45.8	177.9	-179.4	65.8	0	0	0	111.7	L795 V799 L811 P818 I829 A832 T845 L846 S851 M852 G853	L795-L849 HydrophobicContact CD2-CD1 4.14Å; V799-L849 HydrophobicContact CG2-CD2 4.1Å; L811-L849 HydrophobicContact CD1-CB 4.28Å; L811-L849 HydrophobicContact CD1-CD1 4.24Å; L811-L849 HydrophobicContact CD2-CD1 4Å; P818-L849 HydrophobicContact CB-CD1 3.77Å; I829-L849 HydrophobicContact CG1-CD2 4.34Å; I829-L849 HydrophobicContact CG1-CG 4.06Å; A832-L849 HydrophobicContact CB-CD2 4.43Å; T845-L849 PolarHBondContact O-N 2.88Å; L846-L849 HydrophobicContact CD2-CD2 4.33Å; L846-L849 PolarHBondContact O-N 3.37Å; L846-L849 VanDerWaalsContact O-N 3.14Å; L849-S851 VanDerWaalsContact C-N 3.32Å; L849-S851 PolarHBondContact O-N 3.25Å; L849-M852 PolarHBondContact O-N 3.03Å; L849-G853 PolarHBondContact O-N 3.16Å
850	F	94	Very high	91.7	Very high	4 Å²	4	46 Å²	46	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-66.8	-31.8	178.8	-64	-13	0	0	0	112.4	I829 A832 T833 L846 S847 R848 M852 G853 V855 I879 L882 L883 H886	I829-F850 HydrophobicContact CB-CD1 4.46Å; I829-F850 HydrophobicContact CB-CE1 4.41Å; I829-F850 HydrophobicContact CG1-CD1 4.15Å; I829-F850 HydrophobicContact CG2-CD1 3.83Å; I829-F850 HydrophobicContact CG2-CE1 3.75Å; A832-F850 HydrophobicContact CB-CE1 4.38Å; T833-F850 HydrophobicContact CG2-CZ 4.36Å; L846-F850 HydrophobicContact CB-CE2 4.26Å; L846-F850 HydrophobicContact CB-CZ 4.27Å; L846-F850 HydrophobicContact CD2-CZ 4.47Å; L846-F850 WeakPolarHBondContact O-CB 3.38Å; L846-F850 WeakPolarHBondContact O-CD2 3.2Å; L846-F850 WeakPolarHBondContact O-CG 3.46Å; L846-F850 PolarHBondContact O-N 3.01Å; S847-F850 PolarHBondContact O-N 3.4Å; R848-F850 PolarHBondContact O-N 3.29Å; F850-M852 PolarHBondContact O-N 3Å; F850-G853 VanDerWaalsContact O-O 3.11Å; F850-V855 HydrophobicContact CB-CG1 3.72Å; F850-V855 HydrophobicContact CD1-CG1 4.37Å; F850-V855 HydrophobicContact CG-CG1 4.05Å; F850-I879 HydrophobicContact CZ-CG2 4.43Å; F850-L882 HydrophobicContact CD2-CB 4.2Å; F850-L882 HydrophobicContact CE2-CB 4.07Å; F850-L883 HydrophobicContact CD1-CD2 4.34Å; F850-L883 HydrophobicContact CD2-CD2 3.89Å; F850-L883 HydrophobicContact CD2-CG 4.37Å; F850-L883 HydrophobicContact CE1-CD2 4.13Å; F850-L883 HydrophobicContact CE2-CD2 3.65Å; F850-L883 HydrophobicContact CE2-CG 3.87Å; F850-L883 HydrophobicContact CG-CD2 4.24Å; F850-L883 HydrophobicContact CZ-CD2 3.78Å; F850-L883 HydrophobicContact CZ-CG 4.24Å; F850-H886 HydrophobicContact CB-CB 4.19Å
851	S	91.9	Very high	91.8	Very high	78 Å²	78	44.8 Å²	44.8	55%	0.545	25%	0.248	S	C	.	.	H	α-helix	trans	-68.9	-22.9	174.2	78	0	0	0	0	113.9	S847 R848 L849	S847-S851 WeakPolarHBondContact O-CB 3.48Å; S847-S851 PolarHBondContact O-N 3.26Å; R848-S851 PolarHBondContact O-N 3.49Å; R848-S851 PolarHBondContact O-OG 3.47Å; L849-S851 VanDerWaalsContact C-N 3.32Å; L849-S851 PolarHBondContact O-N 3.25Å
852	M	90.2	Very high	91.7	Very high	77 Å²	77	47.8 Å²	47.8	38%	0.379	27%	0.269	S	S	.	.	H	α-helix	trans	-95.8	-14.3	-176.5	-73.6	-173.6	52.1	0	0	114.3	L811 P818 R848 L849 F850	L811-M852 HydrophobicContact CB-SD 4.13Å; L811-M852 HydrophobicContact CD1-SD 4.49Å; L811-M852 HydrophobicContact CD2-CE 3.83Å; L811-M852 HydrophobicContact CD2-SD 3.89Å; L811-M852 HydrophobicContact CG-SD 4.38Å; P818-M852 HydrophobicContact CG-CB 4.35Å; P818-M852 WeakPolarHBondContact CG-O 3.43Å; R848-M852 PolarHBondContact O-N 3.49Å; L849-M852 PolarHBondContact O-N 3.03Å; F850-M852 PolarHBondContact O-N 3Å
853	G	88.3	Confident	91.6	Very high	19 Å²	19	49 Å²	49	20%	0.196	28%	0.279	C	S	.	.	S	Bend	trans	-129.6	-178.9	-178.9	0	0	0	0	0	113.4	D819 L849 F850	D819-G853 VanDerWaalsContact OD1-CA 3.25Å; D819-G853 WeakPolarHBondContact OD1-CA 3.43Å; L849-G853 PolarHBondContact O-N 3.16Å; F850-G853 VanDerWaalsContact O-O 3.11Å
854	D	91	Very high	91.7	Very high	69 Å²	69	54.9 Å²	54.9	37%	0.369	30%	0.299	S	S	.	.			trans	-92	105.7	178.6	-176	7.2	0	0	0	111.3	D819 N856 L857	D819-D854 PolarHBondContact OD1-N 2.62Å; D854-N856 PolarHBondContact O-N 2.8Å; D854-N856 VanDerWaalsContact O-N 3.13Å; D854-N856 WeakPolarHBondContact OD1-CB 3.36Å; D854-N856 PolarHBondContact OD1-N 3.39Å; D854-L857 HydrophobicContact CB-CD1 4.1Å; D854-L857 HydrophobicContact CB-CG 3.9Å; D854-L857 PolarHBondContact O-N 3.49Å
855	V	91.8	Very high	91.8	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.03	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-4	176.9	-62	0	0	0	0	114.2	F850 P867 L883 H886 A888	F850-V855 HydrophobicContact CB-CG1 3.72Å; F850-V855 HydrophobicContact CD1-CG1 4.37Å; F850-V855 HydrophobicContact CG-CG1 4.05Å; V855-P867 WeakPolarHBondContact O-CD 3.46Å; V855-P867 VanDerWaalsContact O-CG 3.24Å; V855-P867 WeakPolarHBondContact O-CG 3.49Å; V855-L883 HydrophobicContact CB-CD2 4.04Å; V855-L883 HydrophobicContact CG1-CD2 4Å; V855-H886 HydrophobicContact CG1-CB 4.1Å; V855-H886 HydrophobicContact CG2-CB 4.49Å; V855-A888 HydrophobicContact CG2-CB 4.22Å
856	N	93.1	Very high	91.9	Very high	56 Å²	56	48.7 Å²	48.7	30%	0.299	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	0.5	-179.9	-64.9	-64.7	0	0	0	114.1	D854 C858 G887 A888 N889	D854-N856 PolarHBondContact O-N 2.8Å; D854-N856 VanDerWaalsContact O-N 3.13Å; D854-N856 WeakPolarHBondContact OD1-CB 3.36Å; D854-N856 PolarHBondContact OD1-N 3.39Å; N856-C858 PolarHBondContact O-N 2.98Å; N856-G887 PolarHBondContact ND2-O 3.21Å; N856-G887 VanDerWaalsContact ND2-O 3.1Å; N856-A888 WeakPolarHBondContact OD1-CA 3.45Å; N856-N889 WeakPolarHBondContact OD1-CB 3.34Å; N856-N889 PolarHBondContact OD1-N 3.48Å
857	L	91.9	Very high	91.9	Very high	51 Å²	51	48.7 Å²	48.7	27%	0.267	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-59.4	132.3	175.8	-71.8	171.4	0	0	0	110.1	D819 M830 D854 P867	D819-L857 HydrophobicContact CB-CD1 3.53Å; M830-L857 HydrophobicContact CE-CB 3.8Å; M830-L857 WeakPolarHBondContact CE-O 3.42Å; D854-L857 HydrophobicContact CB-CD1 4.1Å; D854-L857 HydrophobicContact CB-CG 3.9Å; D854-L857 PolarHBondContact O-N 3.49Å; L857-P867 WeakPolarHBondContact O-CD 3.31Å
858	C	92.7	Very high	92.1	Very high	43 Å²	43	46.9 Å²	46.9	29%	0.291	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-92.9	150.3	175.7	-55.1	0	0	0	0	110.9	M830 N856 R864 Q865	M830-C858 WeakPolarHBondContact CE-O 3.33Å; N856-C858 PolarHBondContact O-N 2.98Å; C858-R864 HydrophobicContact CB-CG 3.71Å; C858-Q865 CarbonylContact C-O 3.53Å; C858-Q865 VanDerWaalsContact CA-O 3.25Å; C858-Q865 WeakPolarHBondContact CA-O 3.4Å
859	T	91.7	Very high	92.2	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-55.8	143	174.5	60.2	0	0	0	0	110.4	G825 F826 M830 T861 R864 Q865 L870	G825-T859 CarbonylContact O-C 3.51Å; G825-T859 VanDerWaalsContact O-CA 3.27Å; G825-T859 WeakPolarHBondContact O-CA 3.34Å; F826-T859 HydrophobicContact CD1-CG2 3.96Å; F826-T859 HydrophobicContact CE1-CG2 3.78Å; F826-T859 HydrophobicContact CZ-CG2 4.46Å; M830-T859 HydrophobicContact CE-CG2 4.44Å; M830-T859 HydrophobicContact SD-CG2 3.72Å; T859-T861 WeakPolarHBondContact CB-OG1 3.37Å; T859-T861 PolarHBondContact O-N 3.29Å; T859-T861 VanDerWaalsContact O-N 3.12Å; T859-T861 PolarHBondContact OG1-OG1 3.37Å; T859-R864 WeakPolarHBondContact O-CA 3.21Å; T859-R864 WeakPolarHBondContact OG1-CA 3.22Å; T859-Q865 HydrophobicContact CG2-CB 4.37Å; T859-Q865 PolarHBondContact N-O 3.49Å; T859-Q865 PolarHBondContact OG1-N 3.37Å; T859-L870 HydrophobicContact CG2-CD1 3.96Å
860	N	90	Very high	92.2	Very high	122 Å²	122	43.3 Å²	43.3	65%	0.652	25%	0.246	S	C	*	.	S	Bend	trans	-85.6	37.1	172.1	-164.7	24.8	0	0	0	111.5	I821 G825	I821-N860 HydrophobicContact CD1-CB 4.04Å; G825-N860 PolarHBondContact O-N 3.02Å
861	T	90.1	Very high	92.3	Very high	47 Å²	47	43.1 Å²	43.1	29%	0.288	25%	0.245	S	C	.	.	S	Bend	trans	-104.4	169.9	175.5	62.7	0	0	0	0	109.5	S824 F826 T859 A863 R864	S824-T861 WeakPolarHBondContact O-CG2 3.23Å; F826-T861 HydrophobicContact CE2-CG2 4.44Å; T859-T861 WeakPolarHBondContact CB-OG1 3.37Å; T859-T861 PolarHBondContact O-N 3.29Å; T859-T861 VanDerWaalsContact O-N 3.12Å; T859-T861 PolarHBondContact OG1-OG1 3.37Å; T861-A863 PolarHBondContact O-N 3.14Å; T861-A863 VanDerWaalsContact O-N 3.15Å; T861-R864 PolarHBondContact O-N 3.48Å; T861-R864 VanDerWaalsContact O-N 3.15Å
862	S	87.1	Confident	92.4	Very high	123 Å²	123	39.4 Å²	39.4	86%	0.86	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.5	176.1	50.7	0	0	0	0	113.5	A895	S862-A895 WeakPolarHBondContact O-CB 3.26Å
863	A	89.5	Confident	92.6	Very high	26 Å²	26	37.8 Å²	37.8	22%	0.215	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-27.9	179	0	0	0	0	0	113.2	T861 Q865 D894 A895	T861-A863 PolarHBondContact O-N 3.14Å; T861-A863 VanDerWaalsContact O-N 3.15Å; A863-Q865 HydrophobicContact CB-CG 3.82Å; A863-Q865 PolarHBondContact O-N 2.99Å; A863-D894 VanDerWaalsContact O-CB 3.31Å; A863-D894 WeakPolarHBondContact O-CB 3.35Å; A863-A895 WeakPolarHBondContact O-CB 3.32Å; A863-A895 PolarHBondContact O-N 3.45Å
864	R	93.1	Very high	92.8	Very high	153 Å²	153	40.8 Å²	40.8	58%	0.577	22%	0.221	S	C	*	.			trans	51.8	49.2	-179.9	-150	-166.5	-170.1	-134.4	1.9	114	C858 T859 T861 A895	C858-R864 HydrophobicContact CB-CG 3.71Å; T859-R864 WeakPolarHBondContact O-CA 3.21Å; T859-R864 WeakPolarHBondContact OG1-CA 3.22Å; T861-R864 PolarHBondContact O-N 3.48Å; T861-R864 VanDerWaalsContact O-N 3.15Å; R864-A895 HydrophobicContact CB-CB 4.12Å
865	Q	94.8	Very high	92.7	Very high	24 Å²	24	38.3 Å²	38.3	11%	0.112	21%	0.211	C	C	.	.			trans	-82	141.1	-174.4	-66.6	170.3	-53.4	0	0	111.7	C858 T859 A863 M869 L870 D894 Y903	C858-Q865 CarbonylContact C-O 3.53Å; C858-Q865 VanDerWaalsContact CA-O 3.25Å; C858-Q865 WeakPolarHBondContact CA-O 3.4Å; T859-Q865 HydrophobicContact CG2-CB 4.37Å; T859-Q865 PolarHBondContact N-O 3.49Å; T859-Q865 PolarHBondContact OG1-N 3.37Å; A863-Q865 HydrophobicContact CB-CG 3.82Å; A863-Q865 PolarHBondContact O-N 2.99Å; Q865-M869 HydrophobicContact CB-CB 4.33Å; Q865-M869 HydrophobicContact CB-SD 4.33Å; Q865-L870 HydrophobicContact CB-CD2 4.01Å; Q865-L870 HydrophobicContact CB-CG 4.26Å; Q865-D894 HydrophobicContact CG-CB 4.38Å; Q865-Y903 VanDerWaalsContact NE2-CZ 3.28Å; Q865-Y903 PolarHBondContact NE2-OH 3.35Å
866	S	94.8	Very high	92.7	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.028	21%	0.211	C	C	.	.			trans	-78.7	161.7	169.9	69.4	0	0	0	0	111.4	L868 M869 L870	S866-L868 PolarHBondContact O-N 2.91Å; S866-M869 PolarHBondContact N-SD 3.17Å; S866-M869 WeakPolarHBondContact O-CB 3.33Å; S866-M869 PolarHBondContact O-N 3.01Å; S866-M869 VanDerWaalsContact OG-CG 3.29Å; S866-M869 WeakPolarHBondContact OG-CG 3.38Å; S866-M869 PolarHBondContact OG-N 2.9Å; S866-M869 PolarHBondContact OG-SD 3.35Å; S866-M869 VanDerWaalsContact OG-SD 3.41Å; S866-L870 PolarHBondContact O-N 2.91Å
867	P	94.8	Very high	92.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-32.1	178.4	-20.2	36.3	0	0	0	111.5	I829 M830 T833 V855 L857 L870 A871 L883	I829-P867 HydrophobicContact CG2-CB 4.28Å; I829-P867 HydrophobicContact CG2-CG 4.24Å; M830-P867 HydrophobicContact CG-CG 4.03Å; T833-P867 HydrophobicContact CG2-CB 3.74Å; V855-P867 WeakPolarHBondContact O-CD 3.46Å; V855-P867 VanDerWaalsContact O-CG 3.24Å; V855-P867 WeakPolarHBondContact O-CG 3.49Å; L857-P867 WeakPolarHBondContact O-CD 3.31Å; P867-L870 PolarHBondContact O-N 3.01Å; P867-A871 WeakPolarHBondContact O-CB 3.37Å; P867-A871 PolarHBondContact O-N 2.85Å; P867-L883 HydrophobicContact CB-CD1 4.29Å; P867-L883 HydrophobicContact CB-CD2 4.22Å
868	L	96.2	Very high	92.8	Very high	2 Å²	2	39 Å²	39	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-66.1	-36.2	174.3	-174.6	63.2	0	0	0	112.2	S866 A872 C880 L883 I884 A888 I890 A900 L916	S866-L868 PolarHBondContact O-N 2.91Å; L868-A872 VanDerWaalsContact O-CB 3.23Å; L868-A872 WeakPolarHBondContact O-CB 3.41Å; L868-A872 PolarHBondContact O-N 2.73Å; L868-C880 HydrophobicContact CD1-CB 4Å; L868-L883 HydrophobicContact CB-CD1 4.33Å; L868-L883 HydrophobicContact CD1-CB 4.29Å; L868-L883 HydrophobicContact CD1-CD1 4.29Å; L868-I884 HydrophobicContact CD1-CD1 4.39Å; L868-I884 HydrophobicContact CD1-CG1 4.15Å; L868-I884 HydrophobicContact CD2-CG1 4.4Å; L868-A888 HydrophobicContact CB-CB 4.36Å; L868-A888 HydrophobicContact CD2-CB 4.29Å; L868-I890 HydrophobicContact CD2-CG1 4.36Å; L868-A900 HydrophobicContact CB-CB 4.49Å; L868-A900 HydrophobicContact CD2-CB 4.06Å; L868-A900 HydrophobicContact CG-CB 3.79Å; L868-L916 HydrophobicContact CD1-CD2 4.47Å; L868-L916 HydrophobicContact CD2-CD2 4.23Å
869	M	96.1	Very high	92.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-68.3	-40.4	173.3	-66.8	158.9	-172.9	0	0	111.8	Q865 S866 A872 L873 A892 D894 N898 A900 Y903	Q865-M869 HydrophobicContact CB-CB 4.33Å; Q865-M869 HydrophobicContact CB-SD 4.33Å; S866-M869 PolarHBondContact N-SD 3.17Å; S866-M869 WeakPolarHBondContact O-CB 3.33Å; S866-M869 PolarHBondContact O-N 3.01Å; S866-M869 VanDerWaalsContact OG-CG 3.29Å; S866-M869 WeakPolarHBondContact OG-CG 3.38Å; S866-M869 PolarHBondContact OG-N 2.9Å; S866-M869 PolarHBondContact OG-SD 3.35Å; S866-M869 VanDerWaalsContact OG-SD 3.41Å; M869-A872 PolarHBondContact O-N 3.48Å; M869-L873 VanDerWaalsContact O-CB 3.3Å; M869-L873 WeakPolarHBondContact O-CB 3.06Å; M869-L873 PolarHBondContact O-N 3.45Å; M869-A892 HydrophobicContact CE-CB 3.8Å; M869-A892 WeakPolarHBondContact CE-O 3.24Å; M869-D894 HydrophobicContact CE-CB 4.29Å; M869-D894 HydrophobicContact SD-CB 3.82Å; M869-N898 WeakPolarHBondContact CE-O 3.47Å; M869-A900 HydrophobicContact CG-CB 4.11Å; M869-Y903 HydrophobicContact CB-CD2 3.82Å; M869-Y903 HydrophobicContact CB-CE2 3.97Å; M869-Y903 HydrophobicContact CG-CD2 3.91Å; M869-Y903 HydrophobicContact CG-CE2 4.06Å; M869-Y903 HydrophobicContact SD-CE2 4.28Å
870	L	94.1	Very high	92.9	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-42.5	176.1	-66.1	178.3	0	0	0	111.6	F826 M830 T833 L834 T859 Q865 S866 P867 L873 H874	F826-L870 HydrophobicContact CD1-CD1 4.25Å; F826-L870 HydrophobicContact CE1-CD1 4.03Å; M830-L870 HydrophobicContact CB-CD1 3.79Å; M830-L870 HydrophobicContact CG-CD1 4.1Å; T833-L870 WeakPolarHBondContact OG1-CB 3.43Å; L834-L870 HydrophobicContact CD2-CB 4.1Å; L834-L870 HydrophobicContact CD2-CD1 4.27Å; L834-L870 HydrophobicContact CD2-CD2 4.08Å; L834-L870 HydrophobicContact CD2-CG 4.38Å; T859-L870 HydrophobicContact CG2-CD1 3.96Å; Q865-L870 HydrophobicContact CB-CD2 4.01Å; Q865-L870 HydrophobicContact CB-CG 4.26Å; S866-L870 PolarHBondContact O-N 2.91Å; P867-L870 PolarHBondContact O-N 3.01Å; L870-L873 WeakPolarHBondContact O-CB 3.43Å; L870-L873 PolarHBondContact O-N 3.31Å; L870-H874 PolarHBondContact O-N 3.09Å; L870-H874 PolarHBondContact O-ND1 2.84Å
871	A	94.7	Very high	93.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.2	-42.1	174.1	0	0	0	0	0	111.7	P867 L873 H874 G875 G876 I879 C880 L883	P867-A871 WeakPolarHBondContact O-CB 3.37Å; P867-A871 PolarHBondContact O-N 2.85Å; A871-L873 VanDerWaalsContact C-N 3.34Å; A871-L873 PolarHBondContact O-N 3.11Å; A871-H874 PolarHBondContact O-N 3.41Å; A871-G875 PolarHBondContact O-N 3.1Å; A871-G876 PolarHBondContact O-N 3.14Å; A871-G876 VanDerWaalsContact O-N 3.1Å; A871-I879 HydrophobicContact CB-CB 4.35Å; A871-I879 HydrophobicContact CB-CG2 3.78Å; A871-C880 VanDerWaalsContact CB-SG 3.56Å; A871-L883 HydrophobicContact CB-CD1 4Å
872	A	94.9	Very high	93.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-34.5	177.3	0	0	0	0	0	112.9	L868 M869 H874 G875 A900 A904 H909 V912	L868-A872 VanDerWaalsContact O-CB 3.23Å; L868-A872 WeakPolarHBondContact O-CB 3.41Å; L868-A872 PolarHBondContact O-N 2.73Å; M869-A872 PolarHBondContact O-N 3.48Å; A872-H874 VanDerWaalsContact C-N 3.34Å; A872-G875 PolarHBondContact O-N 2.98Å; A872-A900 HydrophobicContact CB-CB 4.19Å; A872-A900 WeakPolarHBondContact CB-O 3.26Å; A872-A904 HydrophobicContact CB-CB 4.3Å; A872-H909 PolarHBondContact O-CD2 2.89Å; A872-V912 HydrophobicContact CB-CG1 3.94Å
873	L	93.9	Very high	93.6	Very high	43 Å²	43	27 Å²	27	23%	0.225	14%	0.143	C	C	.	.	H	α-helix	trans	-61	-41.9	173.8	174.5	65.7	0	0	0	111.6	M869 L870 A871 Y903 H907 H909	M869-L873 VanDerWaalsContact O-CB 3.3Å; M869-L873 WeakPolarHBondContact O-CB 3.06Å; M869-L873 PolarHBondContact O-N 3.45Å; L870-L873 WeakPolarHBondContact O-CB 3.43Å; L870-L873 PolarHBondContact O-N 3.31Å; A871-L873 VanDerWaalsContact C-N 3.34Å; A871-L873 PolarHBondContact O-N 3.11Å; L873-Y903 HydrophobicContact CB-CD1 4.41Å; L873-Y903 HydrophobicContact CD1-CD1 4.08Å; L873-H907 WeakPolarHBondContact CD1-CE1 3.48Å; L873-H907 WeakPolarHBondContact CD1-NE2 3.47Å; L873-H909 PolarHBondContact O-NE2 3.49Å
874	H	91.7	Very high	93.7	Very high	83 Å²	83	27.6 Å²	27.6	38%	0.384	14%	0.142	S	C	.	.	H	α-helix	trans	-90	-6.5	-177.5	-65.8	81.8	0	0	0	114.1	L834 L870 A871 A872	L834-H874 WeakPolarHBondContact CD2-CE1 3.33Å; L870-H874 PolarHBondContact O-N 3.09Å; L870-H874 PolarHBondContact O-ND1 2.84Å; A871-H874 PolarHBondContact O-N 3.41Å; A872-H874 VanDerWaalsContact C-N 3.34Å
875	G	89.7	Confident	93.7	Very high	16 Å²	16	24.2 Å²	24.2	17%	0.165	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	17.7	177.7	0	0	0	0	0	115	A871 A872 V877 H909	A871-G875 PolarHBondContact O-N 3.1Å; A872-G875 PolarHBondContact O-N 2.98Å; G875-V877 PolarHBondContact O-N 3.07Å; G875-H909 PolarHBondContact N-CD2 3.46Å; G875-H909 PolarHBondContact N-NE2 3.41Å
876	G	91.6	Very high	93.5	Very high	3 Å²	3	25.8 Å²	25.8	3%	0.031	15%	0.154	C	C	.	.			trans	-74.7	88.2	-179	0	0	0	0	0	112.4	A871 D878 I879 C880	A871-G876 PolarHBondContact O-N 3.14Å; A871-G876 VanDerWaalsContact O-N 3.1Å; G876-D878 PolarHBondContact O-N 3.09Å; G876-I879 PolarHBondContact O-N 2.69Å; G876-C880 WeakPolarHBondContact O-CB 3.49Å; G876-C880 PolarHBondContact O-N 3.43Å; G876-C880 PolarHBondContact O-SG 2.79Å
877	V	93.5	Very high	93.2	Very high	54 Å²	54	28 Å²	28	33%	0.327	18%	0.177	S	C	.	.	H	α-helix	trans	-61.3	-44.5	-177.6	-175.7	0	0	0	0	112	G875 C880 S881 V912 C915	G875-V877 PolarHBondContact O-N 3.07Å; V877-C880 PolarHBondContact O-N 3.16Å; V877-S881 WeakPolarHBondContact O-CB 3.46Å; V877-S881 PolarHBondContact O-N 2.74Å; V877-S881 PolarHBondContact O-OG 3.47Å; V877-V912 HydrophobicContact CG2-CG2 3.93Å; V877-C915 HydrophobicContact CG1-CB 4.4Å
878	D	92.9	Very high	93.1	Very high	70 Å²	70	28.4 Å²	28.4	37%	0.374	18%	0.181	S	C	.	.	H	α-helix	trans	-65.6	-41	-179.6	-61.8	-39.9	0	0	0	111.4	L843 G876 S881 L882	L843-D878 HydrophobicContact CD1-CB 4.03Å; L843-D878 HydrophobicContact CD2-CB 3.88Å; G876-D878 PolarHBondContact O-N 3.09Å; D878-S881 PolarHBondContact O-N 3.05Å; D878-L882 WeakPolarHBondContact O-CB 3.35Å; D878-L882 WeakPolarHBondContact O-CG 3.42Å; D878-L882 PolarHBondContact O-N 2.71Å
879	I	93.6	Very high	92.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-43.7	177	-62.7	176.9	0	0	0	110.7	T833 S835 I837 L846 F850 A871 G876 S881 L882 L883	T833-I879 HydrophobicContact CG2-CG2 3.87Å; S835-I879 WeakPolarHBondContact O-CD1 3.19Å; I837-I879 HydrophobicContact CB-CD1 4.49Å; L846-I879 HydrophobicContact CD1-CG1 4.39Å; F850-I879 HydrophobicContact CZ-CG2 4.43Å; A871-I879 HydrophobicContact CB-CB 4.35Å; A871-I879 HydrophobicContact CB-CG2 3.78Å; G876-I879 PolarHBondContact O-N 2.69Å; I879-S881 VanDerWaalsContact C-N 3.3Å; I879-S881 PolarHBondContact O-N 3.11Å; I879-L882 PolarHBondContact O-N 3.42Å; I879-L883 HydrophobicContact CG2-CD1 3.94Å; I879-L883 HydrophobicContact CG2-CG 4.29Å; I879-L883 WeakPolarHBondContact O-CB 3.34Å; I879-L883 VanDerWaalsContact O-CG 3.28Å; I879-L883 WeakPolarHBondContact O-CG 3.39Å; I879-L883 PolarHBondContact O-N 2.7Å
880	C	94.5	Very high	92.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.6	-46.4	174.7	-68.9	0	0	0	0	110.8	L868 A871 G876 V877 L882 L883 I884	L868-C880 HydrophobicContact CD1-CB 4Å; A871-C880 VanDerWaalsContact CB-SG 3.56Å; G876-C880 WeakPolarHBondContact O-CB 3.49Å; G876-C880 PolarHBondContact O-N 3.43Å; G876-C880 PolarHBondContact O-SG 2.79Å; V877-C880 PolarHBondContact O-N 3.16Å; C880-L882 PolarHBondContact O-N 3.09Å; C880-L883 PolarHBondContact O-N 3.16Å; C880-I884 WeakPolarHBondContact O-CD1 3.49Å; C880-I884 WeakPolarHBondContact O-CG1 3.3Å; C880-I884 PolarHBondContact O-N 3.38Å
881	S	92.9	Very high	92.7	Very high	52 Å²	52	35 Å²	35	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-61.7	-43.8	178.5	-56	0	0	0	0	111.7	V877 D878 I879 I884 A885 C915	V877-S881 WeakPolarHBondContact O-CB 3.46Å; V877-S881 PolarHBondContact O-N 2.74Å; V877-S881 PolarHBondContact O-OG 3.47Å; D878-S881 PolarHBondContact O-N 3.05Å; I879-S881 VanDerWaalsContact C-N 3.3Å; I879-S881 PolarHBondContact O-N 3.11Å; S881-I884 PolarHBondContact O-N 2.91Å; S881-A885 WeakPolarHBondContact O-CB 3.38Å; S881-A885 PolarHBondContact O-N 3.06Å; S881-C915 PolarHBondContact OG-SG 2.81Å; S881-C915 VanDerWaalsContact OG-SG 3.32Å
882	L	92.8	Very high	92.7	Very high	34 Å²	34	35.8 Å²	35.8	18%	0.178	22%	0.223	C	C	.	.	H	α-helix	trans	-63.4	-44.2	175.5	-77.2	179.4	0	0	0	112.5	L843 L846 F850 D878 I879 C880 A885 H886	L843-L882 HydrophobicContact CB-CD1 4.06Å; L843-L882 HydrophobicContact CD2-CD1 3.48Å; L843-L882 VanDerWaalsContact CD2-CD1 3.48Å; L843-L882 HydrophobicContact CG-CD1 4.34Å; L846-L882 HydrophobicContact CB-CD1 4.33Å; F850-L882 HydrophobicContact CD2-CB 4.2Å; F850-L882 HydrophobicContact CE2-CB 4.07Å; D878-L882 WeakPolarHBondContact O-CB 3.35Å; D878-L882 WeakPolarHBondContact O-CG 3.42Å; D878-L882 PolarHBondContact O-N 2.71Å; I879-L882 PolarHBondContact O-N 3.42Å; C880-L882 PolarHBondContact O-N 3.09Å; L882-A885 PolarHBondContact O-N 2.85Å; L882-H886 PolarHBondContact O-N 3.43Å; L882-H886 VanDerWaalsContact O-N 3.11Å; L882-H886 PolarHBondContact O-ND1 3.43Å
883	L	94.3	Very high	92.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-44	178.1	-73.4	169.5	0	0	0	111.4	T833 F850 V855 P867 L868 A871 I879 C880 A885 H886 G887 A888	T833-L883 HydrophobicContact CG2-CD1 3.75Å; T833-L883 HydrophobicContact CG2-CD2 4.33Å; T833-L883 HydrophobicContact CG2-CG 4.48Å; F850-L883 HydrophobicContact CD1-CD2 4.34Å; F850-L883 HydrophobicContact CD2-CD2 3.89Å; F850-L883 HydrophobicContact CD2-CG 4.37Å; F850-L883 HydrophobicContact CE1-CD2 4.13Å; F850-L883 HydrophobicContact CE2-CD2 3.65Å; F850-L883 HydrophobicContact CE2-CG 3.87Å; F850-L883 HydrophobicContact CG-CD2 4.24Å; F850-L883 HydrophobicContact CZ-CD2 3.78Å; F850-L883 HydrophobicContact CZ-CG 4.24Å; V855-L883 HydrophobicContact CB-CD2 4.04Å; V855-L883 HydrophobicContact CG1-CD2 4Å; P867-L883 HydrophobicContact CB-CD1 4.29Å; P867-L883 HydrophobicContact CB-CD2 4.22Å; L868-L883 HydrophobicContact CB-CD1 4.33Å; L868-L883 HydrophobicContact CD1-CB 4.29Å; L868-L883 HydrophobicContact CD1-CD1 4.29Å; A871-L883 HydrophobicContact CB-CD1 4Å; I879-L883 HydrophobicContact CG2-CD1 3.94Å; I879-L883 HydrophobicContact CG2-CG 4.29Å; I879-L883 WeakPolarHBondContact O-CB 3.34Å; I879-L883 VanDerWaalsContact O-CG 3.28Å; I879-L883 WeakPolarHBondContact O-CG 3.39Å; I879-L883 PolarHBondContact O-N 2.7Å; C880-L883 PolarHBondContact O-N 3.16Å; L883-A885 VanDerWaalsContact C-N 3.34Å; L883-A885 PolarHBondContact O-N 3.2Å; L883-H886 CarbonylContact O-C 3.6Å; L883-H886 PolarHBondContact O-N 3.1Å; L883-H886 VanDerWaalsContact O-N 3.12Å; L883-G887 PolarHBondContact O-N 3.41Å; L883-A888 HydrophobicContact CB-CB 3.9Å; L883-A888 WeakPolarHBondContact O-CB 3.14Å; L883-A888 PolarHBondContact O-N 3.12Å
884	I	93.5	Very high	92.6	Very high	38 Å²	38	38 Å²	38	20%	0.195	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-44.4	176.8	-67.3	161	0	0	0	110.3	L868 C880 S881 H886 G887 I890 L916	L868-I884 HydrophobicContact CD1-CD1 4.39Å; L868-I884 HydrophobicContact CD1-CG1 4.15Å; L868-I884 HydrophobicContact CD2-CG1 4.4Å; C880-I884 WeakPolarHBondContact O-CD1 3.49Å; C880-I884 WeakPolarHBondContact O-CG1 3.3Å; C880-I884 PolarHBondContact O-N 3.38Å; S881-I884 PolarHBondContact O-N 2.91Å; I884-H886 PolarHBondContact O-N 2.87Å; I884-G887 PolarHBondContact O-N 2.8Å; I884-I890 HydrophobicContact CG1-CG1 4.22Å; I884-I890 HydrophobicContact CG2-CD1 4.32Å; I884-L916 HydrophobicContact CD1-CD2 3.94Å
885	A	91.4	Very high	92.7	Very high	82 Å²	82	36.5 Å²	36.5	68%	0.678	23%	0.234	S	C	*	.	H	α-helix	trans	-60.4	-28.3	176.2	0	0	0	0	0	113.2	S881 L882 L883	S881-A885 WeakPolarHBondContact O-CB 3.38Å; S881-A885 PolarHBondContact O-N 3.06Å; L882-A885 PolarHBondContact O-N 2.85Å; L883-A885 VanDerWaalsContact C-N 3.34Å; L883-A885 PolarHBondContact O-N 3.2Å
886	H	91.2	Very high	92.9	Very high	57 Å²	57	38.2 Å²	38.2	26%	0.264	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	11.1	176.5	-69.5	82.3	0	0	0	113.9	S847 F850 V855 L882 L883 I884	S847-H886 PolarHBondContact O-NE2 3.13Å; S847-H886 PolarHBondContact OG-CE1 2.68Å; S847-H886 VanDerWaalsContact OG-CE1 3.27Å; F850-H886 HydrophobicContact CB-CB 4.19Å; V855-H886 HydrophobicContact CG1-CB 4.1Å; V855-H886 HydrophobicContact CG2-CB 4.49Å; L882-H886 PolarHBondContact O-N 3.43Å; L882-H886 VanDerWaalsContact O-N 3.11Å; L882-H886 PolarHBondContact O-ND1 3.43Å; L883-H886 CarbonylContact O-C 3.6Å; L883-H886 PolarHBondContact O-N 3.1Å; L883-H886 VanDerWaalsContact O-N 3.12Å; I884-H886 PolarHBondContact O-N 2.87Å
887	G	89.1	Confident	92.9	Very high	49 Å²	49	38.4 Å²	38.4	51%	0.505	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	30.9	174.1	0	0	0	0	0	114.6	N856 L883 I884	N856-G887 PolarHBondContact ND2-O 3.21Å; N856-G887 VanDerWaalsContact ND2-O 3.1Å; L883-G887 PolarHBondContact O-N 3.41Å; I884-G887 PolarHBondContact O-N 2.8Å
888	A	92.1	Very high	93	Very high	9 Å²	9	36.9 Å²	36.9	7%	0.074	24%	0.235	C	C	.	.			trans	-62.3	137.2	168.6	0	0	0	0	0	111.4	V855 N856 L868 L883 I890	V855-A888 HydrophobicContact CG2-CB 4.22Å; N856-A888 WeakPolarHBondContact OD1-CA 3.45Å; L868-A888 HydrophobicContact CB-CB 4.36Å; L868-A888 HydrophobicContact CD2-CB 4.29Å; L883-A888 HydrophobicContact CB-CB 3.9Å; L883-A888 WeakPolarHBondContact O-CB 3.14Å; L883-A888 PolarHBondContact O-N 3.12Å; A888-I890 PolarHBondContact O-N 3.1Å; A888-I890 VanDerWaalsContact O-N 3.11Å
889	N	92.3	Very high	93.1	Very high	84 Å²	84	33.8 Å²	33.8	45%	0.449	22%	0.219	S	C	.	.			trans	-76.4	99.4	177.7	-178.6	8.4	0	0	0	109.8	N856 N891 A892	N856-N889 WeakPolarHBondContact OD1-CB 3.34Å; N856-N889 PolarHBondContact OD1-N 3.48Å; N889-N891 PolarHBondContact O-N 3.46Å; N889-N891 PolarHBondContact OD1-N 3.29Å; N889-N891 VanDerWaalsContact OD1-N 3.11Å; N889-A892 HydrophobicContact CB-CB 4.18Å; N889-A892 WeakPolarHBondContact O-CB 3.32Å; N889-A892 PolarHBondContact O-N 2.91Å; N889-A892 VanDerWaalsContact O-N 3.12Å; N889-A892 PolarHBondContact OD1-N 2.98Å
890	I	93.5	Very high	93.2	Very high	20 Å²	20	33.9 Å²	33.9	10%	0.103	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.9	179.1	-61.6	153.3	0	0	0	112.1	L868 I884 A888 L916 C919 L922	L868-I890 HydrophobicContact CD2-CG1 4.36Å; I884-I890 HydrophobicContact CG1-CG1 4.22Å; I884-I890 HydrophobicContact CG2-CD1 4.32Å; A888-I890 PolarHBondContact O-N 3.1Å; A888-I890 VanDerWaalsContact O-N 3.11Å; I890-L916 HydrophobicContact CG2-CD2 4.2Å; I890-C919 HydrophobicContact CD1-CB 3.58Å; I890-L922 HydrophobicContact CG2-CB 4.26Å; I890-L922 HydrophobicContact CG2-CD1 3.53Å; I890-L922 HydrophobicContact CG2-CG 4.49Å
891	N	93.5	Very high	93.3	Very high	42 Å²	42	34 Å²	34	23%	0.225	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	12.2	-176.2	-65.8	-24.5	0	0	0	113.3	N889 D921 D923 L926	N889-N891 PolarHBondContact O-N 3.46Å; N889-N891 PolarHBondContact OD1-N 3.29Å; N889-N891 VanDerWaalsContact OD1-N 3.11Å; N891-D921 PolarHBondContact ND2-O 3.47Å; N891-D923 PolarHBondContact OD1-N 3.18Å; N891-L926 HydrophobicContact CB-CD1 3.83Å
892	A	93	Very high	93.4	Very high	16 Å²	16	31.6 Å²	31.6	13%	0.132	20%	0.203	C	C	.	.			trans	-58.4	144.3	172.9	0	0	0	0	0	110.1	M869 N889 T899	M869-A892 HydrophobicContact CE-CB 3.8Å; M869-A892 WeakPolarHBondContact CE-O 3.24Å; N889-A892 HydrophobicContact CB-CB 4.18Å; N889-A892 WeakPolarHBondContact O-CB 3.32Å; N889-A892 PolarHBondContact O-N 2.91Å; N889-A892 VanDerWaalsContact O-N 3.12Å; N889-A892 PolarHBondContact OD1-N 2.98Å; A892-T899 WeakPolarHBondContact O-CA 3.27Å
893	Q	93.4	Very high	93.5	Very high	78 Å²	78	30.9 Å²	30.9	36%	0.364	20%	0.198	S	C	.	.			trans	-117.9	137	173.9	-69.6	-176.8	-68.6	0	0	109.8	G897 N898 T899 V927	Q893-G897 PolarHBondContact NE2-O 3.02Å; Q893-N898 WeakPolarHBondContact CA-O 3.1Å; Q893-T899 HydrophobicContact CG-CG2 3.83Å; Q893-V927 PolarHBondContact NE2-O 3.01Å
894	D	94.3	Very high	93.5	Very high	11 Å²	11	30.9 Å²	30.9	6%	0.059	20%	0.198	C	C	.	.			trans	-74.9	-175	175	87.1	-27.9	0	0	0	110.8	A863 Q865 M869 S896 G897 N898 Y903	A863-D894 VanDerWaalsContact O-CB 3.31Å; A863-D894 WeakPolarHBondContact O-CB 3.35Å; Q865-D894 HydrophobicContact CG-CB 4.38Å; M869-D894 HydrophobicContact CE-CB 4.29Å; M869-D894 HydrophobicContact SD-CB 3.82Å; D894-S896 PolarHBondContact O-N 3.49Å; D894-S896 VanDerWaalsContact OD1-C 3.26Å; D894-S896 VanDerWaalsContact OD1-CA 3.24Å; D894-S896 WeakPolarHBondContact OD1-CA 3.43Å; D894-S896 WeakPolarHBondContact OD1-CB 3.5Å; D894-S896 PolarHBondContact OD1-N 3.32Å; D894-S896 PolarHBondContact OD2-OG 3.06Å; D894-G897 PolarHBondContact O-N 3.4Å; D894-G897 VanDerWaalsContact O-N 3.08Å; D894-G897 PolarHBondContact OD1-N 2.88Å; D894-N898 PolarHBondContact N-O 2.61Å; D894-N898 WeakPolarHBondContact OD1-CA 3.39Å; D894-N898 WeakPolarHBondContact OD1-CB 3.38Å; D894-N898 PolarHBondContact OD1-N 2.86Å; D894-Y903 PolarHBondContact OD2-OH 2.71Å
895	A	93.3	Very high	93.5	Very high	51 Å²	51	29.1 Å²	29.1	42%	0.421	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-21	177.2	0	0	0	0	0	113.7	S862 A863 R864 N929	S862-A895 WeakPolarHBondContact O-CB 3.26Å; A863-A895 WeakPolarHBondContact O-CB 3.32Å; A863-A895 PolarHBondContact O-N 3.45Å; R864-A895 HydrophobicContact CB-CB 4.12Å; A895-N929 PolarHBondContact O-ND2 3.29Å
896	S	93.4	Very high	93.5	Very high	53 Å²	53	30.3 Å²	30.3	37%	0.371	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-1.5	177.4	-47.8	0	0	0	0	112.9	D894 N898 N929	D894-S896 PolarHBondContact O-N 3.49Å; D894-S896 VanDerWaalsContact OD1-C 3.26Å; D894-S896 VanDerWaalsContact OD1-CA 3.24Å; D894-S896 WeakPolarHBondContact OD1-CA 3.43Å; D894-S896 WeakPolarHBondContact OD1-CB 3.5Å; D894-S896 PolarHBondContact OD1-N 3.32Å; D894-S896 PolarHBondContact OD2-OG 3.06Å; S896-N898 VanDerWaalsContact C-N 3.29Å; S896-N929 VanDerWaalsContact C-CG 3.41Å; S896-N929 VanDerWaalsContact CA-ND2 3.33Å; S896-N929 WeakPolarHBondContact CA-ND2 3.48Å; S896-N929 WeakPolarHBondContact O-CB 3.4Å; S896-N929 PolarHBondContact O-N 3.3Å; S896-N929 PolarHBondContact O-ND2 2.87Å; S896-N929 PolarHBondContact O-OD1 3.28Å
897	G	93.2	Very high	93.5	Very high	6 Å²	6	31.5 Å²	31.5	6%	0.062	19%	0.186	C	C	.	.	S	Bend	trans	80.1	4.9	-173.9	0	0	0	0	0	114.2	Q893 D894	Q893-G897 PolarHBondContact NE2-O 3.02Å; D894-G897 PolarHBondContact O-N 3.4Å; D894-G897 VanDerWaalsContact O-N 3.08Å; D894-G897 PolarHBondContact OD1-N 2.88Å
898	N	95.5	Very high	93.6	Very high	22 Å²	22	30.2 Å²	30.2	12%	0.118	17%	0.173	C	C	.	.			trans	-75.9	137.1	-179.3	-68.3	-42.5	0	0	0	111.4	M869 Q893 D894 S896 M902 Y903 D928	M869-N898 WeakPolarHBondContact CE-O 3.47Å; Q893-N898 WeakPolarHBondContact CA-O 3.1Å; D894-N898 PolarHBondContact N-O 2.61Å; D894-N898 WeakPolarHBondContact OD1-CA 3.39Å; D894-N898 WeakPolarHBondContact OD1-CB 3.38Å; D894-N898 PolarHBondContact OD1-N 2.86Å; S896-N898 VanDerWaalsContact C-N 3.29Å; N898-M902 HydrophobicContact CB-CB 4.49Å; N898-M902 HydrophobicContact CB-SD 4.42Å; N898-Y903 HydrophobicContact CB-CD2 4.29Å; N898-Y903 HydrophobicContact CB-CE2 3.79Å; N898-D928 WeakPolarHBondContact OD1-CB 3.46Å
899	T	95.1	Very high	93.7	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.037	18%	0.182	C	C	.	.			trans	-95.1	166.1	172.3	65.7	0	0	0	0	111.5	A892 Q893 L901 M902 Y903 L926	A892-T899 WeakPolarHBondContact O-CA 3.27Å; Q893-T899 HydrophobicContact CG-CG2 3.83Å; T899-L901 PolarHBondContact O-N 3.43Å; T899-M902 HydrophobicContact CG2-CE 4.42Å; T899-M902 WeakPolarHBondContact O-CB 3.29Å; T899-M902 PolarHBondContact O-N 3.39Å; T899-M902 WeakPolarHBondContact OG1-CG 3.33Å; T899-M902 PolarHBondContact OG1-N 3Å; T899-Y903 WeakPolarHBondContact O-CD2 3.4Å; T899-Y903 PolarHBondContact O-N 2.99Å; T899-Y903 VanDerWaalsContact O-N 3.13Å; T899-L926 HydrophobicContact CG2-CB 4.04Å; T899-L926 HydrophobicContact CG2-CD1 3.73Å
900	A	95.7	Very high	93.7	Very high	2 Å²	2	29.7 Å²	29.7	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-56.6	-35.8	174.3	0	0	0	0	0	112.5	L868 M869 A872 Y903 A904 L916	L868-A900 HydrophobicContact CB-CB 4.49Å; L868-A900 HydrophobicContact CD2-CB 4.06Å; L868-A900 HydrophobicContact CG-CB 3.79Å; M869-A900 HydrophobicContact CG-CB 4.11Å; A872-A900 HydrophobicContact CB-CB 4.19Å; A872-A900 WeakPolarHBondContact CB-O 3.26Å; A900-Y903 PolarHBondContact O-N 3.2Å; A900-A904 PolarHBondContact O-N 2.95Å; A900-L916 HydrophobicContact CB-CD1 4.22Å
901	L	95.6	Very high	93.6	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-42.2	175.1	-179	65.4	0	0	0	111.8	T899 Y903 A904 I905 V913 L916 L922 L924 A934	T899-L901 PolarHBondContact O-N 3.43Å; L901-Y903 VanDerWaalsContact C-N 3.34Å; L901-Y903 PolarHBondContact O-N 3.37Å; L901-A904 PolarHBondContact O-N 3.39Å; L901-I905 HydrophobicContact CD1-CD1 4.2Å; L901-I905 HydrophobicContact CD1-CG1 4.42Å; L901-I905 HydrophobicContact CD2-CD1 4.49Å; L901-I905 HydrophobicContact CG-CD1 3.83Å; L901-I905 HydrophobicContact CG-CG1 4.48Å; L901-I905 WeakPolarHBondContact O-CD1 3.14Å; L901-I905 WeakPolarHBondContact O-CG1 3.1Å; L901-I905 PolarHBondContact O-N 3.21Å; L901-V913 HydrophobicContact CD1-CG1 4.17Å; L901-V913 HydrophobicContact CD1-CG2 4.37Å; L901-L916 HydrophobicContact CB-CD1 4.08Å; L901-L916 HydrophobicContact CD1-CB 4.24Å; L901-L916 HydrophobicContact CD1-CD1 4.25Å; L901-L922 HydrophobicContact CD2-CD1 4.28Å; L901-L922 HydrophobicContact CD2-CD2 4.08Å; L901-L924 HydrophobicContact CD2-CD2 3.48Å; L901-L924 VanDerWaalsContact CD2-CD2 3.48Å; L901-A934 HydrophobicContact CD2-CB 3.73Å; L901-A934 HydrophobicContact CG-CB 4.25Å
902	M	94.8	Very high	93.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-62.3	-41.9	177.2	-66	172.7	-174.1	0	0	111.5	N898 T899 I905 E906 L926 D928 V937	N898-M902 HydrophobicContact CB-CB 4.49Å; N898-M902 HydrophobicContact CB-SD 4.42Å; T899-M902 HydrophobicContact CG2-CE 4.42Å; T899-M902 WeakPolarHBondContact O-CB 3.29Å; T899-M902 PolarHBondContact O-N 3.39Å; T899-M902 WeakPolarHBondContact OG1-CG 3.33Å; T899-M902 PolarHBondContact OG1-N 3Å; M902-I905 PolarHBondContact O-N 3.37Å; M902-E906 VanDerWaalsContact O-CB 3.3Å; M902-E906 WeakPolarHBondContact O-CB 3.35Å; M902-E906 PolarHBondContact O-N 3.14Å; M902-L926 WeakPolarHBondContact CE-O 3.49Å; M902-D928 HydrophobicContact SD-CB 4.29Å; M902-V937 HydrophobicContact CG-CG2 4.34Å
903	Y	94.5	Very high	93.7	Very high	19 Å²	19	27.6 Å²	27.6	8%	0.075	16%	0.163	C	C	.	.	H	α-helix	trans	-59.9	-46.7	173.5	-82.6	-71.9	0	0	0	112.6	Q865 M869 L873 D894 N898 T899 A900 L901 I905 E906 H907	Q865-Y903 VanDerWaalsContact NE2-CZ 3.28Å; Q865-Y903 PolarHBondContact NE2-OH 3.35Å; M869-Y903 HydrophobicContact CB-CD2 3.82Å; M869-Y903 HydrophobicContact CB-CE2 3.97Å; M869-Y903 HydrophobicContact CG-CD2 3.91Å; M869-Y903 HydrophobicContact CG-CE2 4.06Å; M869-Y903 HydrophobicContact SD-CE2 4.28Å; L873-Y903 HydrophobicContact CB-CD1 4.41Å; L873-Y903 HydrophobicContact CD1-CD1 4.08Å; D894-Y903 PolarHBondContact OD2-OH 2.71Å; N898-Y903 HydrophobicContact CB-CD2 4.29Å; N898-Y903 HydrophobicContact CB-CE2 3.79Å; T899-Y903 WeakPolarHBondContact O-CD2 3.4Å; T899-Y903 PolarHBondContact O-N 2.99Å; T899-Y903 VanDerWaalsContact O-N 3.13Å; A900-Y903 PolarHBondContact O-N 3.2Å; L901-Y903 VanDerWaalsContact C-N 3.34Å; L901-Y903 PolarHBondContact O-N 3.37Å; Y903-I905 VanDerWaalsContact C-N 3.3Å; Y903-I905 PolarHBondContact O-N 3.14Å; Y903-E906 PolarHBondContact O-N 2.69Å; Y903-H907 WeakPolarHBondContact O-CB 3.36Å; Y903-H907 PolarHBondContact O-N 3.36Å; Y903-H907 PolarHBondContact O-ND1 2.96Å
904	A	94.6	Very high	93.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-40.1	178.5	0	0	0	0	0	111.8	A872 A900 L901 G908 H909 V912 V913 L916	A872-A904 HydrophobicContact CB-CB 4.3Å; A900-A904 PolarHBondContact O-N 2.95Å; L901-A904 PolarHBondContact O-N 3.39Å; A904-G908 PolarHBondContact O-N 2.9Å; A904-H909 PolarHBondContact O-N 3.46Å; A904-V912 HydrophobicContact CB-CB 3.99Å; A904-V912 HydrophobicContact CB-CG1 3.71Å; A904-V913 HydrophobicContact CB-CG2 3.79Å; A904-L916 HydrophobicContact CB-CD1 4.47Å
905	I	94.1	Very high	93.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.1	-52.3	176.1	-65.3	162.3	0	0	0	110.5	L901 M902 Y903 H907 G908 V913 A934 V937 A938 K941 I946 I950	L901-I905 HydrophobicContact CD1-CD1 4.2Å; L901-I905 HydrophobicContact CD1-CG1 4.42Å; L901-I905 HydrophobicContact CD2-CD1 4.49Å; L901-I905 HydrophobicContact CG-CD1 3.83Å; L901-I905 HydrophobicContact CG-CG1 4.48Å; L901-I905 WeakPolarHBondContact O-CD1 3.14Å; L901-I905 WeakPolarHBondContact O-CG1 3.1Å; L901-I905 PolarHBondContact O-N 3.21Å; M902-I905 PolarHBondContact O-N 3.37Å; Y903-I905 VanDerWaalsContact C-N 3.3Å; Y903-I905 PolarHBondContact O-N 3.14Å; I905-H907 PolarHBondContact O-N 2.96Å; I905-H907 VanDerWaalsContact O-N 3.17Å; I905-G908 PolarHBondContact O-N 3.32Å; I905-V913 HydrophobicContact CG1-CG2 4.03Å; I905-A934 HydrophobicContact CD1-CB 3.85Å; I905-V937 HydrophobicContact CB-CG1 4.36Å; I905-V937 HydrophobicContact CG2-CB 4.4Å; I905-V937 HydrophobicContact CG2-CG1 3.86Å; I905-A938 HydrophobicContact CG2-CB 3.83Å; I905-K941 WeakPolarHBondContact O-CD 3.43Å; I905-K941 WeakPolarHBondContact O-CE 3.44Å; I905-K941 PolarHBondContact O-NZ 3.38Å; I905-I946 HydrophobicContact CB-CG2 4.39Å; I905-I946 HydrophobicContact CG1-CG2 3.86Å; I905-I946 HydrophobicContact CG2-CG2 4.04Å; I905-I950 HydrophobicContact CD1-CD1 3.3Å; I905-I950 HydrophobicContact CD1-CG1 4.46Å; I905-I950 HydrophobicContact CG1-CD1 3.8Å
906	E	91.7	Very high	93.5	Very high	108 Å²	108	27.5 Å²	27.5	51%	0.505	16%	0.155	S	C	.	.	H	α-helix	trans	-54.5	-38.1	-178.4	-175.4	176.8	-167.9	0	0	111.4	M902 Y903 K941	M902-E906 VanDerWaalsContact O-CB 3.3Å; M902-E906 WeakPolarHBondContact O-CB 3.35Å; M902-E906 PolarHBondContact O-N 3.14Å; Y903-E906 PolarHBondContact O-N 2.69Å; E906-K941 VanDerWaalsContact C-NZ 3.27Å; E906-K941 PolarHBondContact O-NZ 2.78Å
907	H	91.6	Very high	93.4	Very high	82 Å²	82	26.8 Å²	26.8	38%	0.38	15%	0.147	S	C	.	.	H	α-helix	trans	-93.5	-13.7	-179.5	-63.5	76.5	0	0	0	114	L873 Y903 I905 H909 K941	L873-H907 WeakPolarHBondContact CD1-CE1 3.48Å; L873-H907 WeakPolarHBondContact CD1-NE2 3.47Å; Y903-H907 WeakPolarHBondContact O-CB 3.36Å; Y903-H907 PolarHBondContact O-N 3.36Å; Y903-H907 PolarHBondContact O-ND1 2.96Å; I905-H907 PolarHBondContact O-N 2.96Å; I905-H907 VanDerWaalsContact O-N 3.17Å; H907-H909 VanDerWaalsContact CB-CD2 3.46Å; H907-H909 WeakPolarHBondContact CB-CD2 3.4Å; H907-H909 WeakPolarHBondContact CB-NE2 2.98Å; H907-K941 PolarHBondContact O-NZ 3.45Å
908	G	90.5	Very high	93.1	Very high	22 Å²	22	29.7 Å²	29.7	23%	0.227	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	23.6	168.6	0	0	0	0	0	113.1	A904 I905 V910	A904-G908 PolarHBondContact O-N 2.9Å; I905-G908 PolarHBondContact O-N 3.32Å; G908-V910 VanDerWaalsContact C-N 3.33Å; G908-V910 PolarHBondContact O-N 2.97Å
909	H	94	Very high	92.8	Very high	54 Å²	54	29.9 Å²	29.9	25%	0.25	18%	0.18	C	C	.	.			trans	-84.1	78.6	-176	-64	-53.4	0	0	0	110.1	A872 L873 G875 A904 H907 G911 V912 V913	A872-H909 PolarHBondContact O-CD2 2.89Å; L873-H909 PolarHBondContact O-NE2 3.49Å; G875-H909 PolarHBondContact N-CD2 3.46Å; G875-H909 PolarHBondContact N-NE2 3.41Å; A904-H909 PolarHBondContact O-N 3.46Å; H907-H909 VanDerWaalsContact CB-CD2 3.46Å; H907-H909 WeakPolarHBondContact CB-CD2 3.4Å; H907-H909 WeakPolarHBondContact CB-NE2 2.98Å; H909-G911 PolarHBondContact O-N 3.33Å; H909-V912 HydrophobicContact CB-CB 4.09Å; H909-V912 HydrophobicContact CB-CG2 4.03Å; H909-V912 PolarHBondContact O-N 3Å; H909-V913 WeakPolarHBondContact O-CG2 3.47Å; H909-V913 PolarHBondContact O-N 3.27Å
910	V	92.7	Very high	92.1	Very high	28 Å²	28	41.1 Å²	41.1	17%	0.17	22%	0.221	C	C	.	.	H	α-helix	trans	-52.4	-39.9	-178.4	-179.8	0	0	0	0	112.2	G908 V912 V913 K914 E945 I946 L949	G908-V910 VanDerWaalsContact C-N 3.33Å; G908-V910 PolarHBondContact O-N 2.97Å; V910-V912 PolarHBondContact O-N 3.42Å; V910-V913 PolarHBondContact O-N 2.9Å; V910-K914 HydrophobicContact CG1-CD 4.17Å; V910-K914 HydrophobicContact CG1-CG 4.49Å; V910-K914 WeakPolarHBondContact O-CG 3.34Å; V910-K914 PolarHBondContact O-N 3.48Å; V910-E945 HydrophobicContact CG1-CG 4.45Å; V910-E945 WeakPolarHBondContact CG1-OE1 3.28Å; V910-I946 HydrophobicContact CG2-CD1 4.22Å; V910-I946 HydrophobicContact CG2-CG1 3.96Å; V910-L949 HydrophobicContact CG1-CD1 3.9Å
911	G	91.2	Very high	91.5	Very high	34 Å²	34	47 Å²	47	35%	0.351	25%	0.252	S	S	.	.	H	α-helix	trans	-62.1	-41.9	178	0	0	0	0	0	113.2	H909 K914 C915	H909-G911 PolarHBondContact O-N 3.33Å; G911-K914 PolarHBondContact O-N 3.16Å; G911-C915 WeakPolarHBondContact O-CB 3.44Å; G911-C915 PolarHBondContact O-N 2.87Å
912	V	94.2	Very high	91.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.7	-39.4	175.9	179.3	0	0	0	0	110.5	A872 V877 A904 H909 V910 K914 C915 L916	A872-V912 HydrophobicContact CB-CG1 3.94Å; V877-V912 HydrophobicContact CG2-CG2 3.93Å; A904-V912 HydrophobicContact CB-CB 3.99Å; A904-V912 HydrophobicContact CB-CG1 3.71Å; H909-V912 HydrophobicContact CB-CB 4.09Å; H909-V912 HydrophobicContact CB-CG2 4.03Å; H909-V912 PolarHBondContact O-N 3Å; V910-V912 PolarHBondContact O-N 3.42Å; V912-K914 PolarHBondContact O-N 2.93Å; V912-C915 WeakPolarHBondContact O-CB 3.45Å; V912-C915 PolarHBondContact O-N 2.92Å; V912-L916 HydrophobicContact CG1-CD1 3.86Å; V912-L916 HydrophobicContact CG1-CG 4.2Å; V912-L916 WeakPolarHBondContact O-CG 3.48Å; V912-L916 PolarHBondContact O-N 2.88Å
913	V	94.1	Very high	90.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.6	-47.4	174.8	173.7	0	0	0	0	110.8	L901 A904 I905 H909 V910 C915 L916 L917	L901-V913 HydrophobicContact CD1-CG1 4.17Å; L901-V913 HydrophobicContact CD1-CG2 4.37Å; A904-V913 HydrophobicContact CB-CG2 3.79Å; I905-V913 HydrophobicContact CG1-CG2 4.03Å; H909-V913 WeakPolarHBondContact O-CG2 3.47Å; H909-V913 PolarHBondContact O-N 3.27Å; V910-V913 PolarHBondContact O-N 2.9Å; V913-C915 PolarHBondContact O-N 3.43Å; V913-L916 PolarHBondContact O-N 3.43Å; V913-L917 HydrophobicContact CG1-CD1 3.68Å; V913-L917 HydrophobicContact CG1-CG 4.18Å; V913-L917 WeakPolarHBondContact O-CB 3.33Å; V913-L917 VanDerWaalsContact O-CG 3.26Å; V913-L917 WeakPolarHBondContact O-CG 3.25Å; V913-L917 PolarHBondContact O-N 2.63Å
914	K	92.6	Very high	90.7	Very high	104 Å²	104	51.2 Å²	51.2	45%	0.452	28%	0.276	S	S	.	.	H	α-helix	trans	-61.4	-43.1	176.3	-72	175.2	-176.4	165.4	0	111.8	V910 G911 V912 G918 E945 L949	V910-K914 HydrophobicContact CG1-CD 4.17Å; V910-K914 HydrophobicContact CG1-CG 4.49Å; V910-K914 WeakPolarHBondContact O-CG 3.34Å; V910-K914 PolarHBondContact O-N 3.48Å; G911-K914 PolarHBondContact O-N 3.16Å; V912-K914 PolarHBondContact O-N 2.93Å; K914-G918 PolarHBondContact O-N 3.29Å; K914-G918 VanDerWaalsContact O-N 3.1Å; K914-E945 IonicContact NZ-OE1 2.63Å; K914-E945 PolarHBondContact NZ-OE1 3.47Å; K914-E945 VanDerWaalsContact NZ-OE1 3.1Å; K914-L949 HydrophobicContact CD-CD1 4.44Å; K914-L949 HydrophobicContact CG-CD1 3.98Å; K914-L949 HydrophobicContact CG-CD2 4.34Å
915	C	91.4	Very high	90.4	Very high	32 Å²	32	56.1 Å²	56.1	22%	0.216	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-49.2	175.6	178.6	0	0	0	0	111.9	V877 S881 G911 V912 V913 G918	V877-C915 HydrophobicContact CG1-CB 4.4Å; S881-C915 PolarHBondContact OG-SG 2.81Å; S881-C915 VanDerWaalsContact OG-SG 3.32Å; G911-C915 WeakPolarHBondContact O-CB 3.44Å; G911-C915 PolarHBondContact O-N 2.87Å; V912-C915 WeakPolarHBondContact O-CB 3.45Å; V912-C915 PolarHBondContact O-N 2.92Å; V913-C915 PolarHBondContact O-N 3.43Å; C915-G918 PolarHBondContact O-N 3.36Å
916	L	92.9	Very high	90.2	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-68.7	-42	-179.8	-68.1	172.5	0	0	0	112.4	L868 I884 I890 A900 L901 A904 V912 V913 G918 C919 L922	L868-L916 HydrophobicContact CD1-CD2 4.47Å; L868-L916 HydrophobicContact CD2-CD2 4.23Å; I884-L916 HydrophobicContact CD1-CD2 3.94Å; I890-L916 HydrophobicContact CG2-CD2 4.2Å; A900-L916 HydrophobicContact CB-CD1 4.22Å; L901-L916 HydrophobicContact CB-CD1 4.08Å; L901-L916 HydrophobicContact CD1-CB 4.24Å; L901-L916 HydrophobicContact CD1-CD1 4.25Å; A904-L916 HydrophobicContact CB-CD1 4.47Å; V912-L916 HydrophobicContact CG1-CD1 3.86Å; V912-L916 HydrophobicContact CG1-CG 4.2Å; V912-L916 WeakPolarHBondContact O-CG 3.48Å; V912-L916 PolarHBondContact O-N 2.88Å; V913-L916 PolarHBondContact O-N 3.43Å; L916-G918 PolarHBondContact O-N 2.96Å; L916-C919 VanDerWaalsContact O-CB 3.24Å; L916-C919 WeakPolarHBondContact O-CB 3.34Å; L916-C919 PolarHBondContact O-N 2.75Å; L916-L922 WeakPolarHBondContact O-CD2 3.26Å
917	L	91.2	Very high	90.3	Very high	39 Å²	39	56 Å²	56	20%	0.204	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-24.5	177.2	-72.9	175.7	0	0	0	112.9	V913 C919 L922 L924 L949 I950 A953	V913-L917 HydrophobicContact CG1-CD1 3.68Å; V913-L917 HydrophobicContact CG1-CG 4.18Å; V913-L917 WeakPolarHBondContact O-CB 3.33Å; V913-L917 VanDerWaalsContact O-CG 3.26Å; V913-L917 WeakPolarHBondContact O-CG 3.25Å; V913-L917 PolarHBondContact O-N 2.63Å; L917-C919 PolarHBondContact O-N 2.92Å; L917-L922 HydrophobicContact CD2-CD2 3.8Å; L917-L924 HydrophobicContact CD2-CD2 4.24Å; L917-L949 HydrophobicContact CD1-CB 3.98Å; L917-I950 HydrophobicContact CD1-CG1 4.45Å; L917-A953 HydrophobicContact CD2-CB 3.74Å
918	G	88	Confident	90.3	Very high	67 Å²	67	52.7 Å²	52.7	69%	0.691	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-13.5	171.6	0	0	0	0	0	113.9	K914 C915 L916	K914-G918 PolarHBondContact O-N 3.29Å; K914-G918 VanDerWaalsContact O-N 3.1Å; C915-G918 PolarHBondContact O-N 3.36Å; L916-G918 PolarHBondContact O-N 2.96Å
919	C	88.9	Confident	90.5	Very high	26 Å²	26	57.4 Å²	57.4	18%	0.176	32%	0.316	C	S	.	.			trans	-83.1	127.3	-179.5	-61.5	0	0	0	0	111.7	I890 L916 L917 D921 L922	I890-C919 HydrophobicContact CD1-CB 3.58Å; L916-C919 VanDerWaalsContact O-CB 3.24Å; L916-C919 WeakPolarHBondContact O-CB 3.34Å; L916-C919 PolarHBondContact O-N 2.75Å; L917-C919 PolarHBondContact O-N 2.92Å; C919-D921 VanDerWaalsContact C-N 3.34Å; C919-D921 PolarHBondContact O-N 3.01Å; C919-L922 WeakPolarHBondContact O-CB 3.47Å; C919-L922 PolarHBondContact O-N 2.98Å
920	R	80.5	Confident	90.4	Very high	242 Å²	242	60.8 Å²	60.8	91%	0.913	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-32.5	-177.4	-176.1	175.9	176.8	-176.5	-4.2	114.4	L922	R920-L922 VanDerWaalsContact C-N 3.28Å; R920-L922 PolarHBondContact O-N 3.29Å
921	D	82.9	Confident	90.3	Very high	124 Å²	124	61.6 Å²	61.6	66%	0.663	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	3.5	-175.1	-65.9	-21.9	0	0	0	112.9	N891 C919 D923	N891-D921 PolarHBondContact ND2-O 3.47Å; C919-D921 VanDerWaalsContact C-N 3.34Å; C919-D921 PolarHBondContact O-N 3.01Å; D921-D923 PolarHBondContact O-N 3.25Å
922	L	89.7	Confident	90.3	Very high	28 Å²	28	64 Å²	64	15%	0.147	35%	0.351	C	S	.	.			trans	-66	124.3	-179.4	177.6	69.5	0	0	0	111.5	I890 L901 L916 L917 C919 R920 L924	I890-L922 HydrophobicContact CG2-CB 4.26Å; I890-L922 HydrophobicContact CG2-CD1 3.53Å; I890-L922 HydrophobicContact CG2-CG 4.49Å; L901-L922 HydrophobicContact CD2-CD1 4.28Å; L901-L922 HydrophobicContact CD2-CD2 4.08Å; L916-L922 WeakPolarHBondContact O-CD2 3.26Å; L917-L922 HydrophobicContact CD2-CD2 3.8Å; C919-L922 WeakPolarHBondContact O-CB 3.47Å; C919-L922 PolarHBondContact O-N 2.98Å; R920-L922 VanDerWaalsContact C-N 3.28Å; R920-L922 PolarHBondContact O-N 3.29Å; L922-L924 HydrophobicContact CD2-CD2 3.83Å; L922-L924 HydrophobicContact CG-CD2 4.15Å
923	D	88.3	Confident	90.1	Very high	58 Å²	58	65.5 Å²	65.5	31%	0.31	36%	0.359	S	S	.	.			trans	-99.6	108.1	176.4	-171.5	-3.7	0	0	0	111.2	N891 D921 T925 L926	N891-D923 PolarHBondContact OD1-N 3.18Å; D921-D923 PolarHBondContact O-N 3.25Å; D923-T925 VanDerWaalsContact C-N 3.28Å; D923-T925 VanDerWaalsContact CG-OG1 3.26Å; D923-T925 PolarHBondContact O-N 3.26Å; D923-T925 WeakPolarHBondContact OD1-CA 3.44Å; D923-T925 VanDerWaalsContact OD1-CB 3.26Å; D923-T925 WeakPolarHBondContact OD1-CB 3.45Å; D923-T925 WeakPolarHBondContact OD1-CG2 3.01Å; D923-T925 PolarHBondContact OD1-N 2.93Å; D923-T925 PolarHBondContact OD1-OG1 2.89Å; D923-T925 PolarHBondContact OD2-OG1 3.45Å; D923-L926 HydrophobicContact CB-CD1 4.13Å; D923-L926 HydrophobicContact CB-CG 4.09Å
924	L	88.8	Confident	89.9	Confident	26 Å²	26	65.7 Å²	65.7	14%	0.136	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-4	177	-61.1	176.9	0	0	0	113.2	L901 L917 L922 A953 Y954	L901-L924 HydrophobicContact CD2-CD2 3.48Å; L901-L924 VanDerWaalsContact CD2-CD2 3.48Å; L917-L924 HydrophobicContact CD2-CD2 4.24Å; L922-L924 HydrophobicContact CD2-CD2 3.83Å; L922-L924 HydrophobicContact CG-CD2 4.15Å; L924-A953 HydrophobicContact CD1-CB 4.08Å; L924-Y954 HydrophobicContact CB-CD1 4.46Å; L924-Y954 HydrophobicContact CB-CE1 3.79Å; L924-Y954 HydrophobicContact CB-CE2 3.95Å; L924-Y954 HydrophobicContact CD1-CD1 4.41Å; L924-Y954 HydrophobicContact CD1-CD2 3.83Å; L924-Y954 HydrophobicContact CD1-CE1 4.47Å; L924-Y954 HydrophobicContact CD1-CE2 3.9Å; L924-Y954 HydrophobicContact CD1-CG 4.11Å; L924-Y954 HydrophobicContact CD2-CE2 4.49Å; L924-Y954 HydrophobicContact CG-CE2 4.35Å; L924-Y954 PolarHBondContact O-OH 3.47Å
925	T	88.5	Confident	89.8	Confident	104 Å²	104	62.3 Å²	62.3	64%	0.638	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-15.2	-179.4	72.1	0	0	0	0	113.3	D923	D923-T925 VanDerWaalsContact C-N 3.28Å; D923-T925 VanDerWaalsContact CG-OG1 3.26Å; D923-T925 PolarHBondContact O-N 3.26Å; D923-T925 WeakPolarHBondContact OD1-CA 3.44Å; D923-T925 VanDerWaalsContact OD1-CB 3.26Å; D923-T925 WeakPolarHBondContact OD1-CB 3.45Å; D923-T925 WeakPolarHBondContact OD1-CG2 3.01Å; D923-T925 PolarHBondContact OD1-N 2.93Å; D923-T925 PolarHBondContact OD1-OG1 2.89Å; D923-T925 PolarHBondContact OD2-OG1 3.45Å
926	L	91.4	Very high	89.8	Confident	35 Å²	35	63.8 Å²	63.8	18%	0.183	35%	0.353	C	S	.	.			trans	-61.7	140.2	-179.9	-62.3	175.8	0	0	0	111.7	N891 T899 M902 D923 N933	N891-L926 HydrophobicContact CB-CD1 3.83Å; T899-L926 HydrophobicContact CG2-CB 4.04Å; T899-L926 HydrophobicContact CG2-CD1 3.73Å; M902-L926 WeakPolarHBondContact CE-O 3.49Å; D923-L926 HydrophobicContact CB-CD1 4.13Å; D923-L926 HydrophobicContact CB-CG 4.09Å; L926-N933 WeakPolarHBondContact O-CA 3.32Å; L926-N933 WeakPolarHBondContact O-CB 3.47Å
927	V	92.3	Very high	89.6	Confident	69 Å²	69	64.5 Å²	64.5	42%	0.418	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-123.8	144.5	-177.8	-67.9	0	0	0	0	111.1	Q893 K932 N933	Q893-V927 PolarHBondContact NE2-O 3.01Å; V927-K932 WeakPolarHBondContact CA-O 3.48Å; V927-N933 HydrophobicContact CG1-CB 4Å
928	D	92.7	Very high	89.5	Confident	13 Å²	13	62.7 Å²	62.7	7%	0.07	35%	0.348	C	S	.	.			trans	-70.5	176.6	169.1	79.1	-9.8	0	0	0	111.6	N898 M902 N930 G931 K932	N898-D928 WeakPolarHBondContact OD1-CB 3.46Å; M902-D928 HydrophobicContact SD-CB 4.29Å; D928-N930 PolarHBondContact O-N 2.54Å; D928-N930 VanDerWaalsContact O-N 3.1Å; D928-N930 VanDerWaalsContact OD1-C 3.26Å; D928-N930 VanDerWaalsContact OD1-CA 3.27Å; D928-N930 WeakPolarHBondContact OD1-CA 3.43Å; D928-N930 WeakPolarHBondContact OD1-CB 3.37Å; D928-N930 PolarHBondContact OD1-N 3.41Å; D928-N930 PolarHBondContact OD2-ND2 2.91Å; D928-G931 PolarHBondContact O-N 3.06Å; D928-G931 PolarHBondContact OD1-N 3.3Å; D928-K932 PolarHBondContact N-O 2.98Å; D928-K932 WeakPolarHBondContact OD1-CA 3.44Å; D928-K932 WeakPolarHBondContact OD1-CB 3.29Å; D928-K932 PolarHBondContact OD1-N 3.35Å
929	N	93.4	Very high	89.5	Confident	121 Å²	121	65.4 Å²	65.4	65%	0.647	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-13.3	176.9	-71.5	-10.6	0	0	0	113.6	A895 S896	A895-N929 PolarHBondContact O-ND2 3.29Å; S896-N929 VanDerWaalsContact C-CG 3.41Å; S896-N929 VanDerWaalsContact CA-ND2 3.33Å; S896-N929 WeakPolarHBondContact CA-ND2 3.48Å; S896-N929 WeakPolarHBondContact O-CB 3.4Å; S896-N929 PolarHBondContact O-N 3.3Å; S896-N929 PolarHBondContact O-ND2 2.87Å; S896-N929 PolarHBondContact O-OD1 3.28Å
930	N	92.4	Very high	89.5	Confident	125 Å²	125	68.1 Å²	68.1	67%	0.668	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	2.8	173.2	-51.9	-53.9	0	0	0	112.5	D928 K932	D928-N930 PolarHBondContact O-N 2.54Å; D928-N930 VanDerWaalsContact O-N 3.1Å; D928-N930 VanDerWaalsContact OD1-C 3.26Å; D928-N930 VanDerWaalsContact OD1-CA 3.27Å; D928-N930 WeakPolarHBondContact OD1-CA 3.43Å; D928-N930 WeakPolarHBondContact OD1-CB 3.37Å; D928-N930 PolarHBondContact OD1-N 3.41Å; D928-N930 PolarHBondContact OD2-ND2 2.91Å; N930-K932 VanDerWaalsContact C-N 3.29Å; N930-K932 HydrophobicContact CB-CD 4.49Å; N930-K932 HydrophobicContact CB-CG 4.28Å; N930-K932 PolarHBondContact O-N 2.83Å
931	G	90.5	Very high	89.7	Confident	45 Å²	45	60.1 Å²	60.1	46%	0.464	33%	0.332	S	S	.	.	S	Bend	trans	74.2	15.1	-175.7	0	0	0	0	0	114.1	D928	D928-G931 PolarHBondContact O-N 3.06Å; D928-G931 PolarHBondContact OD1-N 3.3Å
932	K	91.2	Very high	89.6	Confident	86 Å²	86	60.2 Å²	60.2	37%	0.374	33%	0.332	S	S	.	.			trans	-88.8	123.2	176.9	-62.4	-180	179.8	176.6	0	109.9	V927 D928 N930 N936 V937	V927-K932 WeakPolarHBondContact CA-O 3.48Å; D928-K932 PolarHBondContact N-O 2.98Å; D928-K932 WeakPolarHBondContact OD1-CA 3.44Å; D928-K932 WeakPolarHBondContact OD1-CB 3.29Å; D928-K932 PolarHBondContact OD1-N 3.35Å; N930-K932 VanDerWaalsContact C-N 3.29Å; N930-K932 HydrophobicContact CB-CD 4.49Å; N930-K932 HydrophobicContact CB-CG 4.28Å; N930-K932 PolarHBondContact O-N 2.83Å; K932-N936 HydrophobicContact CB-CB 4Å; K932-N936 HydrophobicContact CG-CB 4.3Å; K932-V937 HydrophobicContact CB-CG2 4.12Å
933	N	90.7	Very high	89.5	Confident	31 Å²	31	60.9 Å²	60.9	17%	0.166	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-83.9	174.4	165.8	62.8	8.3	0	0	0	111	L926 V927 L935 N936 V937 Y954	L926-N933 WeakPolarHBondContact O-CA 3.32Å; L926-N933 WeakPolarHBondContact O-CB 3.47Å; V927-N933 HydrophobicContact CG1-CB 4Å; N933-L935 PolarHBondContact O-N 3.02Å; N933-L935 PolarHBondContact OD1-N 3.28Å; N933-N936 PolarHBondContact O-N 3.22Å; N933-N936 WeakPolarHBondContact OD1-CB 3.19Å; N933-N936 PolarHBondContact OD1-N 2.94Å; N933-N936 PolarHBondContact OD1-ND2 3.46Å; N933-N936 PolarHBondContact OD1-OD1 2.88Å; N933-V937 WeakPolarHBondContact O-CG2 3.38Å; N933-V937 PolarHBondContact O-N 3.38Å; N933-Y954 PolarHBondContact ND2-OH 2.85Å
934	A	89.8	Confident	89.4	Confident	3 Å²	3	63.7 Å²	63.7	3%	0.025	35%	0.35	C	S	.	.	H	α-helix	trans	-53.1	-39.3	178.4	0	0	0	0	0	113.1	L901 I905 V937 A938	L901-A934 HydrophobicContact CD2-CB 3.73Å; L901-A934 HydrophobicContact CG-CB 4.25Å; I905-A934 HydrophobicContact CD1-CB 3.85Å; A934-V937 PolarHBondContact O-N 2.92Å; A934-A938 WeakPolarHBondContact O-CB 3.41Å; A934-A938 PolarHBondContact O-N 3.33Å
935	L	90.6	Very high	89.4	Confident	33 Å²	33	67 Å²	67	17%	0.173	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-42.6	175.7	-177.6	62.2	0	0	0	112.6	N933 A938 K939 L947 I950 Y954	N933-L935 PolarHBondContact O-N 3.02Å; N933-L935 PolarHBondContact OD1-N 3.28Å; L935-A938 PolarHBondContact O-N 3.19Å; L935-K939 WeakPolarHBondContact O-CG 3.37Å; L935-K939 PolarHBondContact O-N 2.89Å; L935-L947 HydrophobicContact CD1-CD2 4.36Å; L935-I950 HydrophobicContact CB-CG2 4.35Å; L935-I950 HydrophobicContact CD1-CG2 4.09Å; L935-Y954 HydrophobicContact CB-CD2 4.45Å; L935-Y954 HydrophobicContact CB-CE2 3.66Å; L935-Y954 HydrophobicContact CD2-CE2 4.44Å; L935-Y954 HydrophobicContact CG-CE2 4.47Å
936	N	90.5	Very high	89.4	Confident	64 Å²	64	62.1 Å²	62.1	34%	0.342	34%	0.335	S	S	.	.	H	α-helix	trans	-67.1	-38	178.2	-70.1	-16.9	0	0	0	111.4	K932 N933 K939 S940	K932-N936 HydrophobicContact CB-CB 4Å; K932-N936 HydrophobicContact CG-CB 4.3Å; N933-N936 PolarHBondContact O-N 3.22Å; N933-N936 WeakPolarHBondContact OD1-CB 3.19Å; N933-N936 PolarHBondContact OD1-N 2.94Å; N933-N936 PolarHBondContact OD1-ND2 3.46Å; N933-N936 PolarHBondContact OD1-OD1 2.88Å; N936-K939 PolarHBondContact O-N 2.88Å; N936-S940 PolarHBondContact O-N 3.47Å
937	V	88.5	Confident	89.2	Confident	15 Å²	15	61.5 Å²	61.5	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-47.2	173.4	-179.6	0	0	0	0	110.2	M902 I905 K932 N933 A934 K939 S940 K941	M902-V937 HydrophobicContact CG-CG2 4.34Å; I905-V937 HydrophobicContact CB-CG1 4.36Å; I905-V937 HydrophobicContact CG2-CB 4.4Å; I905-V937 HydrophobicContact CG2-CG1 3.86Å; K932-V937 HydrophobicContact CB-CG2 4.12Å; N933-V937 WeakPolarHBondContact O-CG2 3.38Å; N933-V937 PolarHBondContact O-N 3.38Å; A934-V937 PolarHBondContact O-N 2.92Å; V937-K939 VanDerWaalsContact C-N 3.34Å; V937-K939 PolarHBondContact O-N 3.3Å; V937-S940 PolarHBondContact O-N 2.81Å; V937-S940 VanDerWaalsContact O-N 3.14Å; V937-S940 PolarHBondContact O-OG 3.39Å; V937-K941 PolarHBondContact O-N 3.39Å
938	A	89.2	Confident	89.1	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-40.2	177.2	0	0	0	0	0	112.8	I905 A934 L935 S940 K941 N942 I946 L947 I950	I905-A938 HydrophobicContact CG2-CB 3.83Å; A934-A938 WeakPolarHBondContact O-CB 3.41Å; A934-A938 PolarHBondContact O-N 3.33Å; L935-A938 PolarHBondContact O-N 3.19Å; A938-S940 VanDerWaalsContact C-N 3.32Å; A938-S940 PolarHBondContact O-N 3.49Å; A938-K941 PolarHBondContact O-N 2.97Å; A938-N942 PolarHBondContact O-N 3.46Å; A938-I946 HydrophobicContact CB-CG2 4.2Å; A938-L947 HydrophobicContact CB-CD2 3.68Å; A938-L947 HydrophobicContact CB-CG 4.11Å; A938-I950 HydrophobicContact CB-CD1 3.59Å
939	K	88.9	Confident	88.8	Confident	124 Å²	124	64.3 Å²	64.3	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-39.8	175.1	-76.3	177.3	-179.6	175.9	0	111.9	L935 N936 V937 K941 N942 L947	L935-K939 WeakPolarHBondContact O-CG 3.37Å; L935-K939 PolarHBondContact O-N 2.89Å; N936-K939 PolarHBondContact O-N 2.88Å; V937-K939 VanDerWaalsContact C-N 3.34Å; V937-K939 PolarHBondContact O-N 3.3Å; K939-K941 VanDerWaalsContact C-N 3.25Å; K939-K941 PolarHBondContact O-N 3.06Å; K939-N942 PolarHBondContact O-N 3.29Å; K939-L947 HydrophobicContact CB-CD2 4.35Å; K939-L947 HydrophobicContact CG-CD2 3.66Å
940	S	87.8	Confident	88.4	Confident	83 Å²	83	58.6 Å²	58.6	58%	0.58	31%	0.314	S	S	*	.	H	α-helix	trans	-67.7	-26.3	179.4	73	0	0	0	0	113.4	N936 V937 A938	N936-S940 PolarHBondContact O-N 3.47Å; V937-S940 PolarHBondContact O-N 2.81Å; V937-S940 VanDerWaalsContact O-N 3.14Å; V937-S940 PolarHBondContact O-OG 3.39Å; A938-S940 VanDerWaalsContact C-N 3.32Å; A938-S940 PolarHBondContact O-N 3.49Å
941	K	84.7	Confident	88.1	Confident	74 Å²	74	58.1 Å²	58.1	32%	0.322	31%	0.307	S	S	.	.	H	α-helix	trans	-81.3	-21.8	178.1	-172	168	178.1	150.2	0	113.6	I905 E906 H907 V937 A938 K939 D943	I905-K941 WeakPolarHBondContact O-CD 3.43Å; I905-K941 WeakPolarHBondContact O-CE 3.44Å; I905-K941 PolarHBondContact O-NZ 3.38Å; E906-K941 VanDerWaalsContact C-NZ 3.27Å; E906-K941 PolarHBondContact O-NZ 2.78Å; H907-K941 PolarHBondContact O-NZ 3.45Å; V937-K941 PolarHBondContact O-N 3.39Å; A938-K941 PolarHBondContact O-N 2.97Å; K939-K941 VanDerWaalsContact C-N 3.25Å; K939-K941 PolarHBondContact O-N 3.06Å; K941-D943 HydrophobicContact CD-CB 4.39Å; K941-D943 HydrophobicContact CG-CB 4.19Å; K941-D943 PolarHBondContact O-N 2.82Å
942	N	82.5	Confident	87.6	Confident	126 Å²	126	59.4 Å²	59.4	67%	0.674	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	29.3	-175.9	-162	39.8	0	0	0	113.8	A938 K939 L944	A938-N942 PolarHBondContact O-N 3.46Å; K939-N942 PolarHBondContact O-N 3.29Å; N942-L944 PolarHBondContact O-N 2.91Å
943	D	86.1	Confident	87	Confident	42 Å²	42	56.9 Å²	56.9	23%	0.225	30%	0.304	C	S	.	.			trans	-88.1	104	173.6	-172.2	-24.6	0	0	0	109.4	K941 E945 I946 L947	K941-D943 HydrophobicContact CD-CB 4.39Å; K941-D943 HydrophobicContact CG-CB 4.19Å; K941-D943 PolarHBondContact O-N 2.82Å; D943-E945 VanDerWaalsContact C-N 3.3Å; D943-E945 PolarHBondContact O-N 3.32Å; D943-E945 PolarHBondContact OD1-N 3.47Å; D943-E945 VanDerWaalsContact OD1-N 3.09Å; D943-I946 HydrophobicContact CB-CB 4.24Å; D943-I946 HydrophobicContact CB-CD1 4.38Å; D943-I946 HydrophobicContact CB-CG1 4.42Å; D943-I946 PolarHBondContact O-N 3.49Å; D943-I946 PolarHBondContact OD1-N 3.01Å; D943-I946 VanDerWaalsContact OD2-CD1 3.25Å; D943-I946 WeakPolarHBondContact OD2-CD1 3.27Å; D943-L947 VanDerWaalsContact O-CB 3.29Å; D943-L947 WeakPolarHBondContact O-CB 2.99Å; D943-L947 VanDerWaalsContact O-CG 3.28Å; D943-L947 WeakPolarHBondContact O-CG 3.2Å; D943-L947 PolarHBondContact O-N 2.89Å
944	L	87	Confident	86.2	Confident	117 Å²	117	58.9 Å²	58.9	61%	0.613	31%	0.31	S	S	*	.	H	α-helix	trans	-63.3	-33.3	-176.1	-64.9	175.3	0	0	0	112.6	N942 N948	N942-L944 PolarHBondContact O-N 2.91Å; L944-N948 WeakPolarHBondContact O-CB 3.38Å; L944-N948 PolarHBondContact O-N 3.02Å; L944-N948 PolarHBondContact O-ND2 3.2Å; L944-N948 VanDerWaalsContact O-ND2 3.17Å
945	E	88	Confident	84.7	Confident	97 Å²	97	62.9 Å²	62.9	45%	0.453	34%	0.338	S	S	.	.	H	α-helix	trans	-68.4	-50.2	179.9	-173	179.7	174.8	0	0	110.1	V910 K914 D943 L947 N948 L949	V910-E945 HydrophobicContact CG1-CG 4.45Å; V910-E945 WeakPolarHBondContact CG1-OE1 3.28Å; K914-E945 IonicContact NZ-OE1 2.63Å; K914-E945 PolarHBondContact NZ-OE1 3.47Å; K914-E945 VanDerWaalsContact NZ-OE1 3.1Å; D943-E945 VanDerWaalsContact C-N 3.3Å; D943-E945 PolarHBondContact O-N 3.32Å; D943-E945 PolarHBondContact OD1-N 3.47Å; D943-E945 VanDerWaalsContact OD1-N 3.09Å; E945-L947 VanDerWaalsContact C-N 3.34Å; E945-L947 PolarHBondContact O-N 3.34Å; E945-N948 PolarHBondContact O-N 3.42Å; E945-L949 HydrophobicContact CG-CD1 4.27Å; E945-L949 WeakPolarHBondContact O-CG 3.34Å; E945-L949 PolarHBondContact O-N 3.01Å
946	I	89	Confident	82.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-64.3	-40.2	179	-64.5	-179.8	0	0	0	111.3	I905 V910 A938 D943 N948 L949 I950	I905-I946 HydrophobicContact CB-CG2 4.39Å; I905-I946 HydrophobicContact CG1-CG2 3.86Å; I905-I946 HydrophobicContact CG2-CG2 4.04Å; V910-I946 HydrophobicContact CG2-CD1 4.22Å; V910-I946 HydrophobicContact CG2-CG1 3.96Å; A938-I946 HydrophobicContact CB-CG2 4.2Å; D943-I946 HydrophobicContact CB-CB 4.24Å; D943-I946 HydrophobicContact CB-CD1 4.38Å; D943-I946 HydrophobicContact CB-CG1 4.42Å; D943-I946 PolarHBondContact O-N 3.49Å; D943-I946 PolarHBondContact OD1-N 3.01Å; D943-I946 VanDerWaalsContact OD2-CD1 3.25Å; D943-I946 WeakPolarHBondContact OD2-CD1 3.27Å; I946-N948 PolarHBondContact O-N 3.42Å; I946-L949 PolarHBondContact O-N 3.12Å; I946-I950 HydrophobicContact CG2-CD1 3.58Å; I946-I950 HydrophobicContact CG2-CG1 4.35Å; I946-I950 WeakPolarHBondContact O-CB 3.4Å; I946-I950 WeakPolarHBondContact O-CG1 3.36Å; I946-I950 PolarHBondContact O-N 3.33Å
947	L	88.5	Confident	80	Confident	23 Å²	23	68.7 Å²	68.7	12%	0.12	38%	0.379	C	S	.	.	H	α-helix	trans	-58.9	-46.8	175.2	-83.7	169.2	0	0	0	112.2	L935 A938 K939 D943 E945 I950 Q951	L935-L947 HydrophobicContact CD1-CD2 4.36Å; A938-L947 HydrophobicContact CB-CD2 3.68Å; A938-L947 HydrophobicContact CB-CG 4.11Å; K939-L947 HydrophobicContact CB-CD2 4.35Å; K939-L947 HydrophobicContact CG-CD2 3.66Å; D943-L947 VanDerWaalsContact O-CB 3.29Å; D943-L947 WeakPolarHBondContact O-CB 2.99Å; D943-L947 VanDerWaalsContact O-CG 3.28Å; D943-L947 WeakPolarHBondContact O-CG 3.2Å; D943-L947 PolarHBondContact O-N 2.89Å; E945-L947 VanDerWaalsContact C-N 3.34Å; E945-L947 PolarHBondContact O-N 3.34Å; L947-I950 PolarHBondContact O-N 2.67Å; L947-Q951 WeakPolarHBondContact O-CB 3.47Å; L947-Q951 PolarHBondContact O-N 3.49Å
948	N	88.2	Confident	77.6	Confident	103 Å²	103	73.2 Å²	73.2	55%	0.551	41%	0.411	S	S	*	.	H	α-helix	trans	-63.9	-42.5	178.4	-72.8	-20.9	0	0	0	111.6	L944 E945 I946 Q951 S952	L944-N948 WeakPolarHBondContact O-CB 3.38Å; L944-N948 PolarHBondContact O-N 3.02Å; L944-N948 PolarHBondContact O-ND2 3.2Å; L944-N948 VanDerWaalsContact O-ND2 3.17Å; E945-N948 PolarHBondContact O-N 3.42Å; I946-N948 PolarHBondContact O-N 3.42Å; N948-Q951 PolarHBondContact O-N 3.1Å; N948-S952 WeakPolarHBondContact O-CB 3.24Å; N948-S952 PolarHBondContact O-N 3.14Å; N948-S952 PolarHBondContact O-OG 3.5Å
949	L	87.1	Confident	75	Confident	38 Å²	38	82.8 Å²	82.8	20%	0.199	45%	0.453	C	S	.	.	H	α-helix	trans	-59.8	-48.7	176.5	-70.4	169	0	0	0	111.5	V910 K914 L917 E945 I946 S952 A953	V910-L949 HydrophobicContact CG1-CD1 3.9Å; K914-L949 HydrophobicContact CD-CD1 4.44Å; K914-L949 HydrophobicContact CG-CD1 3.98Å; K914-L949 HydrophobicContact CG-CD2 4.34Å; L917-L949 HydrophobicContact CD1-CB 3.98Å; E945-L949 HydrophobicContact CG-CD1 4.27Å; E945-L949 WeakPolarHBondContact O-CG 3.34Å; E945-L949 PolarHBondContact O-N 3.01Å; I946-L949 PolarHBondContact O-N 3.12Å; L949-S952 PolarHBondContact O-N 3.43Å; L949-S952 PolarHBondContact O-OG 3.04Å; L949-A953 PolarHBondContact O-N 3.22Å
950	I	85.8	Confident	72.3	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	46%	0.456	C	S	.	.	H	α-helix	trans	-67.5	-44.3	-179.9	-67.6	166.3	0	0	0	111	I905 L917 L935 A938 I946 L947 S952 A953 Y954	I905-I950 HydrophobicContact CD1-CD1 3.3Å; I905-I950 HydrophobicContact CD1-CG1 4.46Å; I905-I950 HydrophobicContact CG1-CD1 3.8Å; L917-I950 HydrophobicContact CD1-CG1 4.45Å; L935-I950 HydrophobicContact CB-CG2 4.35Å; L935-I950 HydrophobicContact CD1-CG2 4.09Å; A938-I950 HydrophobicContact CB-CD1 3.59Å; I946-I950 HydrophobicContact CG2-CD1 3.58Å; I946-I950 HydrophobicContact CG2-CG1 4.35Å; I946-I950 WeakPolarHBondContact O-CB 3.4Å; I946-I950 WeakPolarHBondContact O-CG1 3.36Å; I946-I950 PolarHBondContact O-N 3.33Å; L947-I950 PolarHBondContact O-N 2.67Å; I950-S952 VanDerWaalsContact C-N 3.27Å; I950-S952 PolarHBondContact O-N 2.94Å; I950-A953 WeakPolarHBondContact O-CB 3.48Å; I950-A953 PolarHBondContact O-N 3.35Å; I950-Y954 HydrophobicContact CG2-CD2 3.5Å; I950-Y954 HydrophobicContact CG2-CE2 3.39Å; I950-Y954 WeakPolarHBondContact O-CD2 3.37Å; I950-Y954 PolarHBondContact O-N 2.94Å
951	Q	84.9	Confident	69.5	Low	115 Å²	115	82.7 Å²	82.7	54%	0.537	47%	0.467	S	S	.	.	H	α-helix	trans	-62.5	-35.5	179.1	-174.3	169.7	-4.4	0	0	112.1	L947 N948 A953 Y954 S955	L947-Q951 WeakPolarHBondContact O-CB 3.47Å; L947-Q951 PolarHBondContact O-N 3.49Å; N948-Q951 PolarHBondContact O-N 3.1Å; Q951-A953 VanDerWaalsContact C-N 3.31Å; Q951-A953 PolarHBondContact O-N 3.42Å; Q951-Y954 PolarHBondContact O-N 2.81Å; Q951-S955 PolarHBondContact O-N 3.42Å; Q951-S955 VanDerWaalsContact O-N 3.14Å; Q951-S955 PolarHBondContact O-OG 3.47Å
952	S	81.3	Confident	66.7	Low	73 Å²	73	84.4 Å²	84.4	51%	0.51	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-38.5	172.8	77.8	0	0	0	0	111.9	N948 L949 I950	N948-S952 WeakPolarHBondContact O-CB 3.24Å; N948-S952 PolarHBondContact O-N 3.14Å; N948-S952 PolarHBondContact O-OG 3.5Å; L949-S952 PolarHBondContact O-N 3.43Å; L949-S952 PolarHBondContact O-OG 3.04Å; I950-S952 VanDerWaalsContact C-N 3.27Å; I950-S952 PolarHBondContact O-N 2.94Å
953	A	77.1	Confident	64.1	Low	32 Å²	32	83.4 Å²	83.4	26%	0.264	49%	0.491	S	S	.	.	H	α-helix	trans	-71.9	-37.3	177	0	0	0	0	0	113.1	L917 L924 L949 I950 Q951 S955	L917-A953 HydrophobicContact CD2-CB 3.74Å; L924-A953 HydrophobicContact CD1-CB 4.08Å; L949-A953 PolarHBondContact O-N 3.22Å; I950-A953 WeakPolarHBondContact O-CB 3.48Å; I950-A953 PolarHBondContact O-N 3.35Å; Q951-A953 VanDerWaalsContact C-N 3.31Å; Q951-A953 PolarHBondContact O-N 3.42Å; A953-S955 VanDerWaalsContact C-N 3.32Å; A953-S955 PolarHBondContact O-N 2.96Å
954	Y	73.8	Confident	61.2	Low	74 Å²	74	88.6 Å²	88.6	29%	0.29	52%	0.524	S	S	.	.	H	α-helix	trans	-68.5	-27.2	175.3	-88.6	-85.6	0	0	0	113.6	L924 N933 L935 I950 Q951 V956	L924-Y954 HydrophobicContact CB-CD1 4.46Å; L924-Y954 HydrophobicContact CB-CE1 3.79Å; L924-Y954 HydrophobicContact CB-CE2 3.95Å; L924-Y954 HydrophobicContact CD1-CD1 4.41Å; L924-Y954 HydrophobicContact CD1-CD2 3.83Å; L924-Y954 HydrophobicContact CD1-CE1 4.47Å; L924-Y954 HydrophobicContact CD1-CE2 3.9Å; L924-Y954 HydrophobicContact CD1-CG 4.11Å; L924-Y954 HydrophobicContact CD2-CE2 4.49Å; L924-Y954 HydrophobicContact CG-CE2 4.35Å; L924-Y954 PolarHBondContact O-OH 3.47Å; N933-Y954 PolarHBondContact ND2-OH 2.85Å; L935-Y954 HydrophobicContact CB-CD2 4.45Å; L935-Y954 HydrophobicContact CB-CE2 3.66Å; L935-Y954 HydrophobicContact CD2-CE2 4.44Å; L935-Y954 HydrophobicContact CG-CE2 4.47Å; I950-Y954 HydrophobicContact CG2-CD2 3.5Å; I950-Y954 HydrophobicContact CG2-CE2 3.39Å; I950-Y954 WeakPolarHBondContact O-CD2 3.37Å; I950-Y954 PolarHBondContact O-N 2.94Å; Q951-Y954 PolarHBondContact O-N 2.81Å; Y954-V956 PolarHBondContact O-N 3.01Å
955	S	58.5	Low	58.5	Low	87 Å²	87	87.7 Å²	87.7	61%	0.608	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-10.7	-175.5	-60.3	0	0	0	0	113.3	Q951 A953 P957	Q951-S955 PolarHBondContact O-N 3.42Å; Q951-S955 VanDerWaalsContact O-N 3.14Å; Q951-S955 PolarHBondContact O-OG 3.47Å; A953-S955 VanDerWaalsContact C-N 3.32Å; A953-S955 PolarHBondContact O-N 2.96Å; S955-P957 WeakPolarHBondContact O-CD 3.07Å
956	V	48.7	Very low	55.6	Low	106 Å²	106	92.4 Å²	92.4	64%	0.642	55%	0.55	S	S	*	*	S	Bend	trans	-76.6	114.8	174.1	-171.3	0	0	0	0	108.4	Y954 S958	Y954-V956 PolarHBondContact O-N 3.01Å; V956-S958 PolarHBondContact O-N 3.35Å; V956-S958 VanDerWaalsContact O-N 3.12Å
957	P	34.8	Very low	52.9	Low	112 Å²	112	96.9 Å²	96.9	73%	0.727	57%	0.573	S	S	*	*			trans	-66.7	116.9	-172.5	25	-31.4	0	0	0	110.4	S955 K959	S955-P957 WeakPolarHBondContact O-CD 3.07Å; P957-K959 PolarHBondContact O-N 3.29Å
958	S	38.8	Very low	50.2	Low	111 Å²	111	98.1 Å²	98.1	78%	0.776	58%	0.583	S	S	*	*			trans	-61.4	120	164.2	65.3	0	0	0	0	107.8	V956 A960	V956-S958 PolarHBondContact O-N 3.35Å; V956-S958 VanDerWaalsContact O-N 3.12Å; S958-A960 VanDerWaalsContact C-N 3.31Å; S958-A960 PolarHBondContact O-N 3.45Å
959	K	33.8	Very low	47.5	Very low	202 Å²	202	98.3 Å²	98.3	88%	0.878	59%	0.59	S	S	*	*	S	Bend	trans	-64.5	84.7	-179.2	-77.9	178.3	173.9	176.6	0	111.4	P957	P957-K959 PolarHBondContact O-N 3.29Å
960	A	32.6	Very low	44.8	Very low	74 Å²	74	100.8 Å²	100.8	61%	0.612	61%	0.611	S	S	*	*			trans	-171.3	96.3	157.3	0	0	0	0	0	106.4	S958	S958-A960 VanDerWaalsContact C-N 3.31Å; S958-A960 PolarHBondContact O-N 3.45Å
961	T	29.3	Very low	42.2	Very low	130 Å²	130	104.7 Å²	104.7	80%	0.798	63%	0.632	S	S	*	*	S	Bend		169.6	148.6	94.4	39.4	0	0	0	0	106.5
962	S	24.2	Very low	39.5	Very low	110 Å²	110	106.4 Å²	106.4	77%	0.769	63%	0.633	S	S	*	*			trans	84.6	128	168.9	82.6	0	0	0	0	119.3
963	S	28.3	Very low	37	Very low	106 Å²	106	109.4 Å²	109.4	74%	0.741	63%	0.634	S	S	*	*			trans	76	116	159.3	73	0	0	0	0	119	S965	S963-S965 PolarHBondContact O-N 2.95Å
964	T	25.5	Very low	34.9	Very low	150 Å²	150	110.7 Å²	110.7	92%	0.92	64%	0.639	S	S	*	*			trans	-61.5	101.1	171.8	49	0	0	0	0	111.1
965	S	29.7	Very low	33	Very low	99 Å²	99	109.1 Å²	109.1	69%	0.692	64%	0.637	S	S	*	*			trans	-118.2	138.1	160.9	55	0	0	0	0	108.9	S963 I967	S963-S965 PolarHBondContact O-N 2.95Å; S965-I967 PolarHBondContact O-N 3.5Å
966	E	28	Very low	31.7	Very low	196 Å²	196	109.4 Å²	109.4	92%	0.916	63%	0.629	S	S	*	*			trans	-62.5	101.8	-160.4	-63.8	171.3	156	0	0	111.8	S968	E966-S968 PolarHBondContact O-N 3.4Å
967	I	31.3	Very low	31	Very low	94 Å²	94	113.2 Å²	113.2	48%	0.482	63%	0.632	S	S	.	*			trans	-66.4	126.5	176.2	-61.1	173.4	0	0	0	108.9	S965 D971 R972	S965-I967 PolarHBondContact O-N 3.5Å; I967-D971 HydrophobicContact CG2-CB 3.33Å; I967-R972 HydrophobicContact CG2-CG 4.33Å
968	S	33.8	Very low	31.2	Very low	48 Å²	48	114 Å²	114	34%	0.336	62%	0.62	S	S	.	*			trans	-57.4	153.6	179.7	90.6	0	0	0	0	111.8	E966 S970 D971 R972	E966-S968 PolarHBondContact O-N 3.4Å; S968-S970 PolarHBondContact O-N 2.93Å; S968-D971 PolarHBondContact O-N 3.47Å; S968-D971 PolarHBondContact OG-N 3.42Å; S968-D971 PolarHBondContact OG-OD2 3.23Å; S968-R972 PolarHBondContact O-N 3.44Å
969	P	29.6	Very low	31.1	Very low	107 Å²	107	112.4 Å²	112.4	70%	0.695	60%	0.603	S	S	*	*	H	α-helix	trans	-59.2	-32.9	-178.2	-21	31.3	0	0	0	113.5	D971 R972 Y973	P969-D971 VanDerWaalsContact C-N 3.32Å; P969-R972 PolarHBondContact O-N 3.09Å; P969-Y973 PolarHBondContact O-N 3.4Å
970	S	31.5	Very low	31.3	Very low	91 Å²	91	106.6 Å²	106.6	64%	0.636	58%	0.584	S	S	*	*	H	α-helix	trans	-66.3	-36.6	177.3	-57.4	0	0	0	0	111.7	S968	S968-S970 PolarHBondContact O-N 2.93Å
971	D	30.8	Very low	31.6	Very low	81 Å²	81	106.7 Å²	106.7	43%	0.433	57%	0.572	S	S	.	*	H	α-helix	trans	-77.7	-29.3	177.8	-64.6	-48.6	0	0	0	112.2	I967 S968 P969 Y973 T974 V975	I967-D971 HydrophobicContact CG2-CB 3.33Å; S968-D971 PolarHBondContact O-N 3.47Å; S968-D971 PolarHBondContact OG-N 3.42Å; S968-D971 PolarHBondContact OG-OD2 3.23Å; P969-D971 VanDerWaalsContact C-N 3.32Å; D971-Y973 VanDerWaalsContact C-N 3.29Å; D971-Y973 PolarHBondContact O-N 3.32Å; D971-T974 PolarHBondContact O-N 3.32Å; D971-T974 PolarHBondContact O-OG1 3.33Å; D971-V975 WeakPolarHBondContact O-CB 3.5Å; D971-V975 WeakPolarHBondContact O-CG2 3.43Å; D971-V975 PolarHBondContact O-N 3.46Å
972	R	28.1	Very low	32.4	Very low	152 Å²	152	108.1 Å²	108.1	57%	0.574	56%	0.563	S	S	*	*	H	α-helix	trans	-60.1	-39.3	172.2	-75.3	-167.5	-164.3	-169.2	3.5	112.2	I967 S968 P969 E976	I967-R972 HydrophobicContact CG2-CG 4.33Å; S968-R972 PolarHBondContact O-N 3.44Å; P969-R972 PolarHBondContact O-N 3.09Å; R972-E976 VanDerWaalsContact O-CB 3.26Å; R972-E976 WeakPolarHBondContact O-CB 3.39Å; R972-E976 WeakPolarHBondContact O-CG 3.37Å; R972-E976 PolarHBondContact O-N 3.38Å
973	Y	28.5	Very low	33.1	Very low	135 Å²	135	108 Å²	108	53%	0.529	55%	0.553	S	S	.	*	H	α-helix	trans	-68.6	-42.7	180	-101.2	-85.9	0	0	0	112.8	P969 D971 R977	P969-Y973 PolarHBondContact O-N 3.4Å; D971-Y973 VanDerWaalsContact C-N 3.29Å; D971-Y973 PolarHBondContact O-N 3.32Å; Y973-R977 PolarHBondContact O-N 2.94Å
974	T	33.4	Very low	33.6	Very low	60 Å²	60	107.6 Å²	107.6	37%	0.368	54%	0.542	S	S	.	.	H	α-helix	trans	-70.6	-37.2	177	63.8	0	0	0	0	111.3	D971 R978	D971-T974 PolarHBondContact O-N 3.32Å; D971-T974 PolarHBondContact O-OG1 3.33Å; T974-R978 WeakPolarHBondContact O-CB 3.22Å; T974-R978 WeakPolarHBondContact O-CG 3.46Å; T974-R978 PolarHBondContact O-N 3.39Å
975	V	33.3	Very low	34.6	Very low	41 Å²	41	102.4 Å²	102.4	25%	0.248	51%	0.509	C	S	.	.	H	α-helix	trans	-69.5	-37.5	175.5	172.8	0	0	0	0	111.3	D971 R978 N979	D971-V975 WeakPolarHBondContact O-CB 3.5Å; D971-V975 WeakPolarHBondContact O-CG2 3.43Å; D971-V975 PolarHBondContact O-N 3.46Å; V975-R978 CarbonylContact O-C 3.59Å; V975-N979 VanDerWaalsContact CG1-ND2 3.33Å; V975-N979 WeakPolarHBondContact CG1-ND2 3.5Å; V975-N979 WeakPolarHBondContact O-CA 3.32Å; V975-N979 WeakPolarHBondContact O-CB 3.38Å; V975-N979 PolarHBondContact O-N 3.04Å; V975-N979 PolarHBondContact O-ND2 3.21Å; V975-N979 PolarHBondContact O-OD1 2.94Å
976	E	31.5	Very low	35.2	Very low	92 Å²	92	101.5 Å²	101.5	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-72.8	-39.6	177.2	-80.6	-179.2	-177.9	0	0	112.1	V338 R972 N979 T980	V338-E976 WeakPolarHBondContact CG1-OE2 3.33Å; R972-E976 VanDerWaalsContact O-CB 3.26Å; R972-E976 WeakPolarHBondContact O-CB 3.39Å; R972-E976 WeakPolarHBondContact O-CG 3.37Å; R972-E976 PolarHBondContact O-N 3.38Å; E976-N979 CarbonylContact O-C 3.58Å; E976-N979 PolarHBondContact O-N 3.18Å; E976-T980 WeakPolarHBondContact O-CG2 3.22Å; E976-T980 PolarHBondContact O-N 3.49Å; E976-T980 PolarHBondContact O-OG1 3.48Å
977	R	34.3	Very low	35.6	Very low	186 Å²	186	95.9 Å²	95.9	70%	0.702	47%	0.472	S	S	*	.	H	α-helix	trans	-62	-47.5	171.9	-147.8	177.6	-171	177.5	2.1	110.2	Y973 N979 T980 H981	Y973-R977 PolarHBondContact O-N 2.94Å; R977-N979 VanDerWaalsContact C-N 3.35Å; R977-N979 PolarHBondContact O-N 2.88Å; R977-T980 PolarHBondContact O-N 3.49Å; R977-T980 PolarHBondContact O-OG1 2.92Å; R977-H981 PolarHBondContact O-CD2 3.24Å; R977-H981 PolarHBondContact O-N 3.3Å; R977-H981 VanDerWaalsContact O-N 3.11Å
978	R	39.3	Very low	36.1	Very low	128 Å²	128	92.5 Å²	92.5	48%	0.483	46%	0.456	S	S	.	.	H	α-helix	trans	-63.7	-36.5	175.6	-74.6	175.3	178.8	140.3	-5.1	112.8	T974 V975 H981 R982	T974-R978 WeakPolarHBondContact O-CB 3.22Å; T974-R978 WeakPolarHBondContact O-CG 3.46Å; T974-R978 PolarHBondContact O-N 3.39Å; V975-R978 CarbonylContact O-C 3.59Å; R978-H981 PolarHBondContact O-N 3.05Å; R978-R982 VanDerWaalsContact O-CB 3.25Å; R978-R982 WeakPolarHBondContact O-CB 3.35Å; R978-R982 PolarHBondContact O-N 3.17Å
979	N	36.7	Very low	36.4	Very low	79 Å²	79	95 Å²	95	42%	0.422	47%	0.466	S	S	.	.	H	α-helix	trans	-72.2	-34.6	176	-76.5	-11.6	0	0	0	110.5	V975 E976 R977 H981 R982 L983	V975-N979 VanDerWaalsContact CG1-ND2 3.33Å; V975-N979 WeakPolarHBondContact CG1-ND2 3.5Å; V975-N979 WeakPolarHBondContact O-CA 3.32Å; V975-N979 WeakPolarHBondContact O-CB 3.38Å; V975-N979 PolarHBondContact O-N 3.04Å; V975-N979 PolarHBondContact O-ND2 3.21Å; V975-N979 PolarHBondContact O-OD1 2.94Å; E976-N979 CarbonylContact O-C 3.58Å; E976-N979 PolarHBondContact O-N 3.18Å; R977-N979 VanDerWaalsContact C-N 3.35Å; R977-N979 PolarHBondContact O-N 2.88Å; N979-H981 VanDerWaalsContact C-N 3.34Å; N979-H981 PolarHBondContact O-N 3.45Å; N979-R982 PolarHBondContact O-N 2.88Å; N979-L983 WeakPolarHBondContact O-CA 3.28Å; N979-L983 WeakPolarHBondContact O-CB 3.36Å; N979-L983 PolarHBondContact O-N 3.02Å
980	T	36.7	Very low	36.7	Very low	79 Å²	79	96.4 Å²	96.4	49%	0.485	47%	0.466	S	S	.	.	H	α-helix	trans	-64.7	-39.7	172.8	54.7	0	0	0	0	111.7	E976 R977 L984	E976-T980 WeakPolarHBondContact O-CG2 3.22Å; E976-T980 PolarHBondContact O-N 3.49Å; E976-T980 PolarHBondContact O-OG1 3.48Å; R977-T980 PolarHBondContact O-N 3.49Å; R977-T980 PolarHBondContact O-OG1 2.92Å; T980-L984 WeakPolarHBondContact O-CB 3.45Å; T980-L984 PolarHBondContact O-N 3.18Å
981	H	40.7	Very low	36.9	Very low	77 Å²	77	95.7 Å²	95.7	36%	0.356	45%	0.453	S	S	.	.	H	α-helix	trans	-68.5	-44.6	175.1	-68.3	-61.9	0	0	0	112.4	R977 R978 N979 L984 L985 L1003	R977-H981 PolarHBondContact O-CD2 3.24Å; R977-H981 PolarHBondContact O-N 3.3Å; R977-H981 VanDerWaalsContact O-N 3.11Å; R978-H981 PolarHBondContact O-N 3.05Å; N979-H981 VanDerWaalsContact C-N 3.34Å; N979-H981 PolarHBondContact O-N 3.45Å; H981-L984 WeakPolarHBondContact O-CB 3Å; H981-L984 PolarHBondContact O-N 3.1Å; H981-L985 PolarHBondContact O-N 2.86Å; H981-L1003 HydrophobicContact CB-CD2 4.28Å; H981-L1003 WeakPolarHBondContact ND1-CD2 3.29Å
982	R	44.2	Very low	37.2	Very low	160 Å²	160	99.9 Å²	99.9	60%	0.604	47%	0.47	S	S	*	.	H	α-helix	trans	-65.2	-40.1	175	-177.4	174.3	176.7	152.6	1.9	111.8	R978 N979 L984 L985 D986	R978-R982 VanDerWaalsContact O-CB 3.25Å; R978-R982 WeakPolarHBondContact O-CB 3.35Å; R978-R982 PolarHBondContact O-N 3.17Å; N979-R982 PolarHBondContact O-N 2.88Å; R982-L984 VanDerWaalsContact C-N 3.31Å; R982-L984 PolarHBondContact O-N 3.42Å; R982-L985 CarbonylContact O-C 3.59Å; R982-L985 PolarHBondContact O-N 2.84Å; R982-D986 WeakPolarHBondContact CG-OD2 3.47Å; R982-D986 IonicContact NE-OD2 3.1Å; R982-D986 VanDerWaalsContact O-CB 3.25Å; R982-D986 WeakPolarHBondContact O-CB 3.26Å; R982-D986 PolarHBondContact O-N 3.05Å
983	L	40.3	Very low	37.7	Very low	106 Å²	106	95.2 Å²	95.2	56%	0.555	46%	0.455	S	S	*	.	H	α-helix	trans	-72	-28.3	178	-157.9	146.9	0	0	0	110.5	N979 L987	N979-L983 WeakPolarHBondContact O-CA 3.28Å; N979-L983 WeakPolarHBondContact O-CB 3.36Å; N979-L983 PolarHBondContact O-N 3.02Å; L983-L987 HydrophobicContact CD2-CD1 3.68Å; L983-L987 HydrophobicContact CD2-CG 4.19Å; L983-L987 WeakPolarHBondContact O-CB 3.48Å; L983-L987 WeakPolarHBondContact O-CD1 3.32Å; L983-L987 WeakPolarHBondContact O-CG 3.36Å; L983-L987 PolarHBondContact O-N 3.48Å
984	L	38.7	Very low	38.2	Very low	99 Å²	99	93.1 Å²	93.1	52%	0.518	46%	0.459	S	S	.	.	H	α-helix	trans	-66.5	-45.2	166.1	-103.3	150.1	0	0	0	112.1	T980 H981 R982 C988	T980-L984 WeakPolarHBondContact O-CB 3.45Å; T980-L984 PolarHBondContact O-N 3.18Å; H981-L984 WeakPolarHBondContact O-CB 3Å; H981-L984 PolarHBondContact O-N 3.1Å; R982-L984 VanDerWaalsContact C-N 3.31Å; R982-L984 PolarHBondContact O-N 3.42Å; L984-C988 WeakPolarHBondContact O-CB 3.44Å; L984-C988 PolarHBondContact O-N 2.94Å; L984-C988 PolarHBondContact O-SG 3.09Å
985	L	46.6	Very low	38.3	Very low	41 Å²	41	92.3 Å²	92.3	22%	0.215	45%	0.453	C	S	.	.	H	α-helix	trans	-66.6	-47.9	176.1	-75.8	166.8	0	0	0	111.6	H981 R982 L987 C988 D989 V995 L1003	H981-L985 PolarHBondContact O-N 2.86Å; R982-L985 CarbonylContact O-C 3.59Å; R982-L985 PolarHBondContact O-N 2.84Å; L985-L987 PolarHBondContact O-N 3.04Å; L985-C988 CarbonylContact O-C 3.49Å; L985-C988 WeakPolarHBondContact O-CA 3.43Å; L985-C988 WeakPolarHBondContact O-CB 3.4Å; L985-C988 PolarHBondContact O-N 3.27Å; L985-D989 PolarHBondContact O-N 3.24Å; L985-V995 HydrophobicContact CD2-CG1 4.19Å; L985-V995 HydrophobicContact CD2-CG2 4.34Å; L985-L1003 HydrophobicContact CD1-CD1 4.24Å; L985-L1003 HydrophobicContact CD2-CD1 3.92Å; L985-L1003 HydrophobicContact CG-CD1 3.98Å
986	D	41.2	Very low	38.5	Very low	80 Å²	80	92.4 Å²	92.4	43%	0.428	46%	0.455	S	S	.	.	H	α-helix	trans	-62	-41	175.8	-70.7	-15.7	0	0	0	110.4	R982 C988 D989 L990	R982-D986 WeakPolarHBondContact CG-OD2 3.47Å; R982-D986 IonicContact NE-OD2 3.1Å; R982-D986 VanDerWaalsContact O-CB 3.25Å; R982-D986 WeakPolarHBondContact O-CB 3.26Å; R982-D986 PolarHBondContact O-N 3.05Å; D986-C988 VanDerWaalsContact C-N 3.3Å; D986-C988 PolarHBondContact O-N 3.19Å; D986-D989 PolarHBondContact O-N 3.46Å; D986-L990 WeakPolarHBondContact O-CB 3.43Å; D986-L990 PolarHBondContact O-N 3.1Å
987	L	36.1	Very low	38.8	Very low	78 Å²	78	97.1 Å²	97.1	41%	0.408	47%	0.474	S	S	.	.	H	α-helix	trans	-62.6	-38.5	170.7	-82.6	167.5	0	0	0	111.4	L983 L985 H991	L983-L987 HydrophobicContact CD2-CD1 3.68Å; L983-L987 HydrophobicContact CD2-CG 4.19Å; L983-L987 WeakPolarHBondContact O-CB 3.48Å; L983-L987 WeakPolarHBondContact O-CD1 3.32Å; L983-L987 WeakPolarHBondContact O-CG 3.36Å; L983-L987 PolarHBondContact O-N 3.48Å; L985-L987 PolarHBondContact O-N 3.04Å; L987-H991 VanDerWaalsContact O-CB 3.22Å; L987-H991 WeakPolarHBondContact O-CB 3.49Å; L987-H991 PolarHBondContact O-CD2 2.94Å; L987-H991 PolarHBondContact O-N 3.3Å; L987-H991 VanDerWaalsContact O-N 3.09Å
988	C	41.7	Very low	38.7	Very low	22 Å²	22	90.4 Å²	90.4	15%	0.149	46%	0.456	C	S	.	.	H	α-helix	trans	-66.4	-45.7	176.1	-70.4	0	0	0	0	111.2	L984 L985 D986 H991 H992 I993 V995	L984-C988 WeakPolarHBondContact O-CB 3.44Å; L984-C988 PolarHBondContact O-N 2.94Å; L984-C988 PolarHBondContact O-SG 3.09Å; L985-C988 CarbonylContact O-C 3.49Å; L985-C988 WeakPolarHBondContact O-CA 3.43Å; L985-C988 WeakPolarHBondContact O-CB 3.4Å; L985-C988 PolarHBondContact O-N 3.27Å; D986-C988 VanDerWaalsContact C-N 3.3Å; D986-C988 PolarHBondContact O-N 3.19Å; C988-H991 CarbonylContact O-C 3.57Å; C988-H991 PolarHBondContact O-N 3.47Å; C988-H992 CarbonylContact O-C 3.55Å; C988-H992 PolarHBondContact O-N 3.34Å; C988-I993 HydrophobicContact CB-CB 3.99Å; C988-I993 PolarHBondContact O-N 3.12Å; C988-V995 HydrophobicContact CB-CG2 3.42Å; C988-V995 VanDerWaalsContact CB-CG2 3.42Å
989	D	41.4	Very low	38.5	Very low	102 Å²	102	88 Å²	88	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-69.2	-44.7	-179.4	-73	-21.6	0	0	0	111.7	L985 D986 H991 H992	L985-D989 PolarHBondContact O-N 3.24Å; D986-D989 PolarHBondContact O-N 3.46Å; D989-H991 PolarHBondContact O-N 3Å; D989-H992 PolarHBondContact O-N 3.11Å
990	L	35.2	Very low	38.5	Very low	135 Å²	135	91.2 Å²	91.2	71%	0.707	46%	0.462	S	S	*	.	H	α-helix	trans	-63	-29.1	176.6	-159.5	87.4	0	0	0	112.1	D986	D986-L990 WeakPolarHBondContact O-CB 3.43Å; D986-L990 PolarHBondContact O-N 3.1Å
991	H	36.3	Very low	38.5	Very low	77 Å²	77	96.2 Å²	96.2	36%	0.356	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	8.3	175.9	-66.8	-56.6	0	0	0	114.1	L987 C988 D989 I993	L987-H991 VanDerWaalsContact O-CB 3.22Å; L987-H991 WeakPolarHBondContact O-CB 3.49Å; L987-H991 PolarHBondContact O-CD2 2.94Å; L987-H991 PolarHBondContact O-N 3.3Å; L987-H991 VanDerWaalsContact O-N 3.09Å; C988-H991 CarbonylContact O-C 3.57Å; C988-H991 PolarHBondContact O-N 3.47Å; D989-H991 PolarHBondContact O-N 3Å; H991-I993 HydrophobicContact CB-CD1 3.86Å; H991-I993 HydrophobicContact CB-CG1 3.8Å; H991-I993 PolarHBondContact O-N 3.05Å
992	H	37.3	Very low	38	Very low	168 Å²	168	97.8 Å²	97.8	78%	0.778	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	36.7	-175.7	-58.6	-57.2	0	0	0	113.4	C988 D989 P994	C988-H992 CarbonylContact O-C 3.55Å; C988-H992 PolarHBondContact O-N 3.34Å; D989-H992 PolarHBondContact O-N 3.11Å; H992-P994 VanDerWaalsContact O-CD 3.27Å; H992-P994 WeakPolarHBondContact O-CD 3.28Å
993	I	39.2	Very low	37.3	Very low	54 Å²	54	94.9 Å²	94.9	28%	0.277	49%	0.492	S	S	.	.			trans	-81.9	113.3	174.8	-56	174.4	0	0	0	107.2	C988 H991 V995	C988-I993 HydrophobicContact CB-CB 3.99Å; C988-I993 PolarHBondContact O-N 3.12Å; H991-I993 HydrophobicContact CB-CD1 3.86Å; H991-I993 HydrophobicContact CB-CG1 3.8Å; H991-I993 PolarHBondContact O-N 3.05Å; I993-V995 PolarHBondContact O-N 3.11Å; I993-V995 VanDerWaalsContact O-N 3.1Å
994	P	37.9	Very low	37.1	Very low	92 Å²	92	94.4 Å²	94.4	60%	0.597	49%	0.488	S	S	*	.			trans	-65.8	114.3	180	20.4	-27.3	0	0	0	111	R218 H992	R218-P994 PolarHBondContact NH2-O 2.94Å; H992-P994 VanDerWaalsContact O-CD 3.27Å; H992-P994 WeakPolarHBondContact O-CD 3.28Å
995	V	35.6	Very low	37.1	Very low	42 Å²	42	94.1 Å²	94.1	26%	0.255	49%	0.487	S	S	.	.			trans	-91	119.6	173	-171.4	0	0	0	0	108.7	L985 C988 I993 I999	L985-V995 HydrophobicContact CD2-CG1 4.19Å; L985-V995 HydrophobicContact CD2-CG2 4.34Å; C988-V995 HydrophobicContact CB-CG2 3.42Å; C988-V995 VanDerWaalsContact CB-CG2 3.42Å; I993-V995 PolarHBondContact O-N 3.11Å; I993-V995 VanDerWaalsContact O-N 3.1Å; V995-I999 HydrophobicContact CG1-CB 3.84Å; V995-I999 HydrophobicContact CG1-CG2 3.72Å
996	P	37.3	Very low	36.5	Very low	44 Å²	44	97.1 Å²	97.1	29%	0.286	50%	0.502	S	S	.	.			trans	-59.1	143.9	176.2	-22.1	32.2	0	0	0	111.8	S998 I999 K1000	P996-S998 PolarHBondContact O-N 3.06Å; P996-I999 HydrophobicContact CG-CD1 4.44Å; P996-I999 PolarHBondContact O-N 2.98Å; P996-K1000 PolarHBondContact O-N 3.12Å
997	K	36.9	Very low	36.2	Very low	190 Å²	190	98.1 Å²	98.1	83%	0.826	51%	0.506	S	S	*	.	H	α-helix	trans	-50.1	-33.1	175	-73.9	-173.2	178.2	-176.2	0	112.6	K1000 F1001	K997-K1000 CarbonylContact O-C 3.38Å; K997-K1000 WeakPolarHBondContact O-CB 3.35Å; K997-K1000 PolarHBondContact O-N 3.22Å; K997-F1001 WeakPolarHBondContact O-CB 3.36Å; K997-F1001 PolarHBondContact O-N 3.27Å
998	S	33.5	Very low	36.3	Very low	46 Å²	46	99.3 Å²	99.3	32%	0.322	51%	0.512	S	S	.	.	H	α-helix	trans	-67.3	-35.2	177	60.1	0	0	0	0	113.6	P996 F1001 C1002	P996-S998 PolarHBondContact O-N 3.06Å; S998-F1001 PolarHBondContact O-N 3.12Å; S998-C1002 WeakPolarHBondContact O-CB 3.25Å; S998-C1002 PolarHBondContact O-N 3.27Å; S998-C1002 PolarHBondContact O-SG 3.05Å
999	I	34.7	Very low	35.9	Very low	76 Å²	76	104.5 Å²	104.5	39%	0.39	54%	0.537	S	S	.	.	H	α-helix	trans	-75.2	-35.6	172.6	-65.4	-178.1	0	0	0	109.5	V995 P996 F1001 C1002 L1003	V995-I999 HydrophobicContact CG1-CB 3.84Å; V995-I999 HydrophobicContact CG1-CG2 3.72Å; P996-I999 HydrophobicContact CG-CD1 4.44Å; P996-I999 PolarHBondContact O-N 2.98Å; I999-F1001 PolarHBondContact O-N 3.29Å; I999-C1002 PolarHBondContact O-N 3.27Å; I999-L1003 HydrophobicContact CG2-CD1 3.46Å; I999-L1003 VanDerWaalsContact CG2-CD1 3.46Å; I999-L1003 HydrophobicContact CG2-CG 3.85Å; I999-L1003 WeakPolarHBondContact O-CB 3.36Å; I999-L1003 VanDerWaalsContact O-CG 3.28Å; I999-L1003 WeakPolarHBondContact O-CG 3.43Å; I999-L1003 PolarHBondContact O-N 3.36Å
1000	K	37.7	Very low	35.5	Very low	148 Å²	148	104.6 Å²	104.6	64%	0.643	54%	0.536	S	S	*	.	H	α-helix	trans	-65.1	-18.2	170.8	-149.4	-179.6	-176	-179	0	113.5	P996 K997	P996-K1000 PolarHBondContact O-N 3.12Å; K997-K1000 CarbonylContact O-C 3.38Å; K997-K1000 WeakPolarHBondContact O-CB 3.35Å; K997-K1000 PolarHBondContact O-N 3.22Å
1001	F	35	Very low	35.5	Very low	184 Å²	184	102.3 Å²	102.3	81%	0.807	52%	0.523	S	S	*	.	H	α-helix	trans	-96.4	-34.2	177.4	-174.4	-89.7	0	0	0	112	K997 S998 I999	K997-F1001 WeakPolarHBondContact O-CB 3.36Å; K997-F1001 PolarHBondContact O-N 3.27Å; S998-F1001 PolarHBondContact O-N 3.12Å; I999-F1001 PolarHBondContact O-N 3.29Å
1002	C	30.7	Very low	35.5	Very low	109 Å²	109	104.4 Å²	104.4	74%	0.736	54%	0.537	S	S	*	.	H	α-helix	trans	-83.7	-25.5	175.4	-71	0	0	0	0	113.8	S998 I999	S998-C1002 WeakPolarHBondContact O-CB 3.25Å; S998-C1002 PolarHBondContact O-N 3.27Å; S998-C1002 PolarHBondContact O-SG 3.05Å; I999-C1002 PolarHBondContact O-N 3.27Å
1003	L	29.7	Very low	35.3	Very low	100 Å²	100	98.6 Å²	98.6	52%	0.524	52%	0.515	S	S	.	.			trans	-84.4	0	165.8	-69.9	172.7	0	0	0	109.1	H981 L985 I999	H981-L1003 HydrophobicContact CB-CD2 4.28Å; H981-L1003 WeakPolarHBondContact ND1-CD2 3.29Å; L985-L1003 HydrophobicContact CD1-CD1 4.24Å; L985-L1003 HydrophobicContact CD2-CD1 3.92Å; L985-L1003 HydrophobicContact CG-CD1 3.98Å; I999-L1003 HydrophobicContact CG2-CD1 3.46Å; I999-L1003 VanDerWaalsContact CG2-CD1 3.46Å; I999-L1003 HydrophobicContact CG2-CG 3.85Å; I999-L1003 WeakPolarHBondContact O-CB 3.36Å; I999-L1003 VanDerWaalsContact O-CG 3.28Å; I999-L1003 WeakPolarHBondContact O-CG 3.43Å; I999-L1003 PolarHBondContact O-N 3.36Å

Retrieved 1,003 of 1,003 residues in 842.4 ms (Link to these results)

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